#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mfw s ARG 6 N 0.00 0.41 0.26 -1.46 3.00 -1.26 -5.11 118.95 114.79 3mfw s ARG 6 Ca 0.00 1.18 -0.29 0.00 0.00 0.00 0.00 55.73 56.61 3mfw s ARG 6 Cb 0.00 0.52 -0.09 0.00 0.00 0.00 0.00 34.95 35.37 3mfw s ARG 6 CO 0.00 -0.23 1.21 0.99 0.00 0.00 0.00 175.30 177.27 3mfw s THR 7 N 2.70 3.25 0.00 0.02 2.01 -1.26 -3.95 115.64 118.40 3mfw s THR 7 Ca -0.03 1.17 0.08 0.00 0.31 0.00 0.00 61.69 63.21 3mfw s THR 7 Cb -0.12 -3.74 -0.02 0.00 0.01 0.00 0.00 72.50 68.62 3mfw s THR 7 CO -0.15 0.24 -0.24 -0.63 -0.69 0.00 0.00 174.62 173.15 3mfw s ILE 8 N -0.73 1.94 -0.24 1.82 -1.09 -0.40 -0.24 121.20 122.26 3mfw s ILE 8 Ca 0.49 -1.13 0.02 0.00 -2.23 0.00 0.00 60.65 57.80 3mfw s ILE 8 Cb -0.35 -1.63 0.06 0.00 -1.58 0.00 0.00 42.46 38.96 3mfw s ILE 8 CO 0.43 0.47 -0.08 -0.83 -1.23 0.00 0.00 174.94 173.70 3mfw s GLY 9 N -0.77 1.43 0.10 6.18 0.00 0.70 -1.27 107.32 113.70 3mfw s GLY 9 Ca 0.10 -1.50 -0.28 0.00 0.00 0.00 0.00 44.72 43.04 3mfw s GLY 9 CO -0.00 0.78 0.87 -0.42 0.00 0.00 0.00 173.10 174.33 3mfw s ILE 10 N 1.28 4.53 -0.17 0.90 -1.09 0.39 -1.07 121.20 125.96 3mfw s ILE 10 Ca -0.07 1.87 0.00 0.00 -2.23 0.00 0.00 60.65 60.23 3mfw s ILE 10 Cb -0.19 -4.23 0.04 0.00 -1.58 0.00 0.00 42.46 36.50 3mfw s ILE 10 CO -0.06 0.37 -0.08 -0.63 -1.23 0.00 0.00 174.94 173.31 3mfw s ILE 11 N -0.26 1.36 0.12 2.92 1.01 -0.05 -0.17 121.20 126.13 3mfw s ILE 11 Ca 0.42 -0.75 -0.28 0.00 0.00 0.00 0.00 60.65 60.04 3mfw s ILE 11 Cb -0.23 -1.45 -0.07 0.00 0.01 0.00 0.00 42.46 40.73 3mfw s ILE 11 CO 0.27 0.20 0.88 -0.83 0.00 0.00 0.00 174.94 175.46 3mfw s GLY 12 N 1.53 2.96 -0.58 6.18 0.00 -0.12 -0.67 107.32 116.62 3mfw s GLY 12 Ca 0.01 0.48 0.05 0.00 0.00 0.00 0.00 44.72 45.26 3mfw s GLY 12 CO -0.08 1.24 0.49 0.00 0.00 0.00 0.00 173.10 174.75 3mfw n ALA 13 N 2.42 3.26 -2.47 3.20 0.00 -0.11 -0.52 120.51 126.29 3mfw n ALA 13 Ca -0.01 -4.04 -0.39 0.00 0.00 0.00 0.00 53.44 49.00 3mfw n ALA 13 Cb 0.49 -0.91 -0.02 0.00 0.00 0.00 0.00 19.45 19.01 3mfw n ALA 13 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3mfw s PRO 14 N -1.13 3.58 -0.01 0.00 0.04 -1.26 -3.51 135.00 132.71 3mfw s PRO 14 Ca 0.30 -1.57 0.00 0.00 0.04 0.00 0.00 61.00 59.77 3mfw s PRO 14 Cb 0.03 -5.42 0.02 0.00 0.04 0.00 0.00 34.50 29.16 3mfw s PRO 14 CO -0.15 -2.58 0.02 0.12 0.04 0.00 0.00 177.00 174.45 3mfw s PHE 15 N 5.79 0.03 0.00 0.56 5.36 -1.26 -4.84 117.98 123.63 3mfw s PHE 15 Ca 0.55 0.09 0.00 0.00 -0.96 0.00 0.00 56.93 56.61 3mfw s PHE 15 Cb 0.02 -0.18 0.00 0.00 -0.34 0.00 0.00 43.02 42.52 3mfw s PHE 15 CO 0.04 -0.07 0.00 -1.13 -1.46 0.00 0.00 175.22 172.61 3mfw n SER 16 N 3.87 0.81 0.00 6.13 3.41 -1.26 -1.58 113.62 124.99 3mfw n SER 16 Ca -0.23 -0.28 0.04 0.00 -0.26 0.00 0.00 58.87 58.13 3mfw n SER 16 Cb 0.53 0.73 0.23 0.00 -0.26 0.00 0.00 64.21 65.44 3mfw n SER 16 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3mfw n LYS 17 N -0.81 0.74 0.00 4.33 5.02 -1.26 -1.92 118.16 124.26 3mfw n LYS 17 Ca 0.00 0.00 0.14 0.00 -2.02 0.00 0.00 58.31 56.43 3mfw n LYS 17 Cb 0.00 -1.16 0.74 0.00 -0.02 0.00 0.00 35.03 34.58 3mfw n LYS 17 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3mfw n GLY 18 N 0.32 -1.13 3.75 0.72 0.00 -1.26 -4.66 105.19 102.93 3mfw n GLY 18 Ca 0.06 -0.14 -0.08 0.00 0.00 0.00 0.00 46.02 45.85 3mfw n GLY 18 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3mfw s GLN 19 N -2.43 1.84 0.28 1.61 1.03 -0.81 -0.64 119.66 120.54 3mfw s GLN 19 Ca 0.30 -1.21 0.19 0.00 0.04 0.00 0.00 55.36 54.69 3mfw s GLN 19 Cb 0.19 0.57 0.11 0.00 0.03 0.00 0.00 33.01 33.91 3mfw s GLN 19 CO 0.40 -0.82 1.34 -1.35 -2.54 0.00 0.00 175.29 172.31 3mfw h PRO 20 N 2.07 0.00 -5.66 9.60 0.11 -1.90 -3.47 132.00 132.76 3mfw h PRO 20 Ca -0.24 0.00 -0.59 0.00 0.11 0.00 0.00 66.00 65.28 3mfw h PRO 20 Cb 1.25 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.27 3mfw h PRO 20 CO 0.31 0.23 -0.06 1.03 -0.21 0.00 0.00 178.00 179.30 3mfw s ARG 21 N -3.10 4.27 0.60 1.05 0.52 -1.26 -5.02 118.95 116.00 3mfw s ARG 21 Ca 0.03 0.48 -0.14 0.00 -0.52 0.00 0.00 55.73 55.57 3mfw s ARG 21 Cb 0.07 -3.51 -0.04 0.00 0.52 0.00 0.00 34.95 32.00 3mfw s ARG 21 CO 0.74 -0.02 1.04 0.20 0.02 0.00 0.00 175.30 177.28 3mfw s GLY 22 N 0.92 1.97 0.00 -3.53 0.00 -1.26 -4.00 107.32 101.43 3mfw s GLY 22 Ca 0.26 0.23 0.00 0.00 0.00 0.00 0.00 44.72 45.21 3mfw s GLY 22 CO 0.10 0.53 0.00 0.61 0.00 0.00 0.00 173.10 174.35 3mfw n GLY 23 N -1.50 1.65 0.32 0.20 0.00 -1.26 -4.79 105.19 99.81 3mfw n GLY 23 Ca 0.08 -0.47 0.21 0.00 0.00 0.00 0.00 46.02 45.84 3mfw n GLY 23 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3mfw h VAL 24 N 0.00 0.09 0.00 1.61 3.04 -1.77 0.88 116.25 120.09 3mfw h VAL 24 Ca 0.00 -0.09 0.00 0.00 -1.01 0.00 0.00 66.70 65.60 3mfw h VAL 24 Cb 0.00 1.08 0.00 0.00 -2.01 0.00 0.00 31.29 30.36 3mfw h VAL 24 CO 0.00 0.01 0.00 1.05 -1.01 0.00 0.00 177.57 177.62 3mfw h GLU 25 N 0.00 0.00 -0.00 4.17 9.09 -1.86 -0.11 114.58 125.87 3mfw h GLU 25 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 3mfw h GLU 25 Cb 0.08 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.18 3mfw h GLU 25 CO 0.00 0.00 -0.11 0.39 0.05 0.00 0.00 179.01 179.34 3mfw n GLU 26 N -2.33 0.75 -0.12 1.06 -0.58 0.30 -4.37 120.64 115.35 3mfw n GLU 26 Ca 0.01 -0.27 -0.05 0.00 -0.42 0.00 0.00 57.16 56.43 3mfw n GLU 26 Cb 0.17 -1.49 0.02 0.00 -0.57 0.00 0.00 31.44 29.56 3mfw n GLU 26 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 3mfw h GLY 27 N 4.96 0.31 0.94 0.62 0.00 -1.52 -0.47 103.07 107.90 3mfw h GLY 27 Ca 0.00 0.12 0.03 0.00 0.00 0.00 0.00 47.33 47.48 3mfw h GLY 27 CO 0.00 -0.15 0.64 -2.55 0.00 0.00 0.00 176.54 174.48 3mfw h PRO 28 N 0.02 1.20 0.27 4.80 0.11 -1.75 0.16 132.00 136.81 3mfw h PRO 28 Ca 0.20 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.22 3mfw h PRO 28 Cb 0.30 -0.27 0.00 0.00 0.11 0.00 0.00 31.00 31.14 3mfw h PRO 28 CO -0.40 0.79 -0.13 1.15 -0.21 0.00 0.00 178.00 179.20 3mfw h THR 29 N 1.23 0.76 0.00 -1.15 2.02 -1.54 -0.93 112.91 113.30 3mfw h THR 29 Ca 0.38 -0.21 -0.08 0.00 0.77 0.00 0.00 66.41 67.27 3mfw h THR 29 Cb -0.01 0.88 -0.01 0.00 -1.74 0.00 0.00 68.15 67.26 3mfw h THR 29 CO -0.11 0.05 -0.39 -0.37 0.37 0.00 0.00 175.52 175.06 3mfw h VAL 30 N -0.47 1.06 -0.47 3.16 -1.51 -0.69 -0.65 116.25 116.67 3mfw h VAL 30 Ca -0.04 -1.46 -0.10 0.00 -1.23 0.00 0.00 66.70 63.87 3mfw h VAL 30 Cb 0.35 1.84 -0.01 0.00 -2.13 0.00 0.00 31.29 31.34 3mfw h VAL 30 CO 0.06 0.38 -0.11 -0.07 -1.23 0.00 0.00 177.57 176.60 3mfw h LEU 31 N 0.00 0.91 -0.75 4.19 3.38 -0.50 -2.13 115.31 120.42 3mfw h LEU 31 Ca -0.00 -0.36 -0.05 0.00 0.09 0.00 0.00 57.88 57.55 3mfw h LEU 31 Cb 0.81 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 3mfw h LEU 31 CO 0.05 1.06 0.26 0.03 0.09 0.00 0.00 178.44 179.94 3mfw h ARG 32 N 0.75 1.14 0.00 1.13 3.08 -0.88 -2.70 114.38 116.91 3mfw h ARG 32 Ca 0.12 -0.23 -0.02 0.00 0.07 0.00 0.00 59.98 59.92 3mfw h ARG 32 Cb 0.66 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 30.53 3mfw h ARG 32 CO 0.05 0.96 -0.10 -0.22 -1.07 0.00 0.00 179.97 179.59 3mfw h LYS 33 N 1.10 0.00 -0.00 0.04 3.64 -0.89 0.61 116.57 121.06 3mfw h LYS 33 Ca 0.24 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.62 3mfw h LYS 33 Cb 0.27 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 3mfw h LYS 33 CO -0.01 0.10 0.00 0.00 -2.27 0.00 0.00 179.45 177.26 3mfw n ALA 34 N -2.37 2.69 -1.29 5.00 0.00 -0.82 -4.88 120.51 118.84 3mfw n ALA 34 Ca -0.02 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.21 3mfw n ALA 34 Cb 0.19 -1.51 0.00 0.00 0.00 0.00 0.00 19.45 18.12 3mfw n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mfw n GLY 35 N 1.00 0.56 0.27 0.00 0.00 0.21 -4.98 105.19 102.25 3mfw n GLY 35 Ca 0.24 -0.83 0.04 0.00 0.00 0.00 0.00 46.02 45.46 3mfw n GLY 35 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3mfw h LEU 36 N 0.00 0.37 -0.67 0.99 5.85 -1.63 -0.32 115.31 119.90 3mfw h LEU 36 Ca 0.00 0.09 -0.12 0.00 0.84 0.00 0.00 57.88 58.68 3mfw h LEU 36 Cb 0.45 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 3mfw h LEU 36 CO 0.00 0.18 -0.29 -0.07 -0.34 0.00 0.00 178.44 177.92 3mfw h LEU 37 N 0.52 0.74 -0.40 2.25 3.38 -1.86 -0.17 115.31 119.78 3mfw h LEU 37 Ca 0.39 -0.29 -0.18 0.00 0.09 0.00 0.00 57.88 57.89 3mfw h LEU 37 Cb 0.51 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 3mfw h LEU 37 CO -0.34 0.98 -0.57 -0.33 0.09 0.00 0.00 178.44 178.27 3mfw h GLU 38 N 0.61 0.70 -0.08 1.13 3.07 -1.81 -1.50 114.58 116.71 3mfw h GLU 38 Ca 0.07 -0.46 -0.11 0.00 -0.50 0.00 0.00 59.36 58.37 3mfw h GLU 38 Cb 0.80 0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 28.75 3mfw h GLU 38 CO 0.07 1.08 -0.43 0.87 -1.40 0.00 0.00 179.01 179.19 3mfw h LYS 39 N 0.53 0.18 -0.32 2.33 1.57 -0.78 -1.93 116.57 118.16 3mfw h LYS 39 Ca 0.01 -0.09 -0.07 0.00 -1.87 0.00 0.00 60.65 58.63 3mfw h LYS 39 Cb 1.15 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.45 3mfw h LYS 39 CO 0.12 0.58 -0.07 -0.07 -0.57 0.00 0.00 179.45 179.44 3mfw h LEU 40 N 0.15 0.61 -2.54 2.94 3.38 -0.83 -2.86 115.31 116.16 3mfw h LEU 40 Ca 0.01 -0.36 -0.00 0.00 0.09 0.00 0.00 57.88 57.62 3mfw h LEU 40 Cb 0.83 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 3mfw h LEU 40 CO 0.06 0.83 -0.01 0.11 0.09 0.00 0.00 178.44 179.52 3mfw h LYS 41 N 0.38 0.00 0.00 1.13 1.57 -0.63 0.14 116.57 119.17 3mfw h LYS 41 Ca 0.08 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.81 3mfw h LYS 41 Cb 0.56 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.86 3mfw h LYS 41 CO 0.03 0.01 -0.26 0.93 -0.57 0.00 0.00 179.45 179.59 3mfw h GLU 42 N 0.00 0.00 0.00 3.15 5.08 -1.13 -3.39 114.58 118.29 3mfw h GLU 42 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3mfw h GLU 42 Cb 0.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.38 3mfw h GLU 42 CO 0.00 0.26 0.00 1.04 -1.00 0.00 0.00 179.01 179.31 3mfw n GLN 43 N -3.45 1.62 0.00 2.33 6.02 0.04 -4.89 117.38 119.05 3mfw n GLN 43 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 3mfw n GLN 43 Cb 0.44 0.00 0.01 0.00 1.02 0.00 0.00 30.24 31.71 3mfw n GLN 43 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 177.06 175.20 3mfw n GLU 44 N -0.08 0.28 -3.64 -1.09 0.28 -1.26 -4.88 120.64 110.24 3mfw n GLU 44 Ca 0.00 0.00 -0.36 0.00 -0.16 0.00 0.00 57.16 56.64 3mfw n GLU 44 Cb 0.00 -1.01 -0.08 0.00 1.43 0.00 0.00 31.44 31.78 3mfw n GLU 44 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3mfw s ASP 46 N 0.45 6.24 -0.20 0.00 -1.08 -1.25 -4.45 116.67 116.37 3mfw s ASP 46 Ca 0.11 -1.11 -0.03 0.00 -0.52 0.00 0.00 52.55 51.01 3mfw s ASP 46 Cb -0.12 -2.43 -0.01 0.00 -1.46 0.00 0.00 42.92 38.91 3mfw s ASP 46 CO 0.01 -1.41 -0.08 -0.69 0.52 0.00 0.00 175.17 173.51 3mfw s VAL 47 N 3.99 3.16 -0.13 1.11 1.01 -1.26 -1.28 120.40 126.99 3mfw s VAL 47 Ca 0.25 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.66 3mfw s VAL 47 Cb -0.15 -2.40 -0.01 0.00 0.00 0.00 0.00 36.38 33.82 3mfw s VAL 47 CO 0.07 0.46 -0.16 -0.75 0.00 0.00 0.00 175.10 174.72 3mfw s LYS 48 N 1.21 3.27 -0.29 2.72 2.20 -0.39 -5.00 119.74 123.44 3mfw s LYS 48 Ca 0.02 -0.74 -0.15 0.00 -0.36 0.00 0.00 55.97 54.74 3mfw s LYS 48 Cb -0.14 -2.57 -0.03 0.00 -1.51 0.00 0.00 37.83 33.58 3mfw s LYS 48 CO -0.03 0.14 0.36 0.34 -0.36 0.00 0.00 175.35 175.81 3mfw s ASP 49 N 0.50 6.22 0.00 1.43 2.15 -1.26 -0.47 116.67 125.23 3mfw s ASP 49 Ca -0.11 0.11 0.23 0.00 0.43 0.00 0.00 52.55 53.21 3mfw s ASP 49 Cb -0.16 -2.20 0.92 0.00 -0.30 0.00 0.00 42.92 41.18 3mfw s ASP 49 CO 0.05 -0.23 1.65 -1.22 -0.17 0.00 0.00 175.17 175.25 3mfw n TYR 50 N 5.34 0.12 -1.13 -5.34 4.02 0.77 -4.92 117.16 116.02 3mfw n TYR 50 Ca -0.09 -0.06 0.00 0.00 -0.01 0.00 0.00 57.90 57.74 3mfw n TYR 50 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.82 3mfw n TYR 50 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3mfw n GLY 51 N 1.10 -2.51 3.61 2.72 0.00 -1.25 -4.85 105.19 104.01 3mfw n GLY 51 Ca 0.17 -1.65 -0.40 0.00 0.00 0.00 0.00 46.02 44.14 3mfw n GLY 51 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3mfw s ASP 52 N -2.44 6.40 0.29 1.61 1.11 -1.26 -0.95 116.67 121.43 3mfw s ASP 52 Ca 0.00 0.45 -0.30 0.00 0.18 0.00 0.00 52.55 52.88 3mfw s ASP 52 Cb 0.00 -2.27 -0.12 0.00 1.07 0.00 0.00 42.92 41.60 3mfw s ASP 52 CO 0.00 -0.28 1.56 0.18 1.18 0.00 0.00 175.17 177.81 3mfw n LEU 53 N 5.52 4.18 -4.47 1.23 4.77 0.32 -4.92 117.00 123.63 3mfw n LEU 53 Ca -0.05 1.15 -0.43 0.00 -0.03 0.00 0.00 56.01 56.66 3mfw n LEU 53 Cb 0.50 -1.57 -0.04 0.00 -2.33 0.00 0.00 43.42 39.98 3mfw n LEU 53 CO 0.40 0.05 0.84 -2.16 -1.33 0.00 0.00 177.39 175.18 3mfw s PRO 54 N -0.58 3.13 -0.58 3.23 0.04 -1.26 -4.58 135.00 134.40 3mfw s PRO 54 Ca 0.64 -0.70 -0.23 0.00 0.04 0.00 0.00 61.00 60.75 3mfw s PRO 54 Cb -0.52 -4.21 0.05 0.00 0.04 0.00 0.00 34.50 29.86 3mfw s PRO 54 CO 0.50 -1.87 0.93 -0.06 0.04 0.00 0.00 177.00 176.53 3mfw s PHE 55 N 4.39 2.77 0.51 0.56 0.08 -1.26 -5.03 117.98 120.00 3mfw s PHE 55 Ca 0.25 -0.20 -0.20 0.00 0.12 0.00 0.00 56.93 56.90 3mfw s PHE 55 Cb -0.15 -4.10 -0.07 0.00 -0.57 0.00 0.00 43.02 38.13 3mfw s PHE 55 CO 0.11 -1.42 1.09 0.00 -0.10 0.00 0.00 175.22 174.90 3mfw s ALA 56 N 3.91 2.80 0.32 5.36 0.00 -1.26 -4.95 121.76 127.94 3mfw s ALA 56 Ca 0.27 0.73 -0.29 0.00 0.00 0.00 0.00 51.96 52.67 3mfw s ALA 56 Cb -0.14 -3.31 -0.12 0.00 0.00 0.00 0.00 23.12 19.55 3mfw s ALA 56 CO 0.16 -0.54 1.53 -3.47 0.00 0.00 0.00 175.76 173.44 3mfw n ASP 57 N -1.06 3.67 -4.04 0.00 4.64 -1.26 -4.98 116.55 113.52 3mfw n ASP 57 Ca 0.10 1.17 -0.33 0.00 -1.38 0.00 0.00 54.79 54.35 3mfw n ASP 57 Cb 0.51 -1.58 -0.12 0.00 -1.04 0.00 0.00 41.12 38.89 3mfw n ASP 57 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 3mfw s ILE 58 N -0.39 3.02 0.24 5.18 1.01 -1.26 -4.98 121.20 124.01 3mfw s ILE 58 Ca 0.61 -2.82 0.01 0.00 0.00 0.00 0.00 60.65 58.45 3mfw s ILE 58 Cb -0.51 -3.06 -0.00 0.00 0.01 0.00 0.00 42.46 38.90 3mfw s ILE 58 CO 0.54 -0.77 1.60 -0.65 0.00 0.00 0.00 174.94 175.66 3mfw h PRO 59 N 7.13 0.45 -4.70 2.79 0.11 -2.04 -3.34 132.00 132.40 3mfw h PRO 59 Ca -0.06 -0.24 -0.71 0.00 0.11 0.00 0.00 66.00 65.10 3mfw h PRO 59 Cb 0.96 0.01 -0.20 0.00 0.11 0.00 0.00 31.00 31.88 3mfw h PRO 59 CO 0.67 0.81 0.47 -0.80 -0.21 0.00 0.00 178.00 178.94 3mfw s ASN 60 N -6.87 6.51 -0.43 -2.05 0.01 -1.26 -4.88 114.94 105.97 3mfw s ASN 60 Ca -0.06 -1.96 0.07 0.00 -0.71 0.00 0.00 52.86 50.20 3mfw s ASN 60 Cb 0.12 -2.33 0.25 0.00 0.41 0.00 0.00 41.25 39.70 3mfw s ASN 60 CO 0.81 -1.00 0.68 -0.67 -1.51 0.00 0.00 177.10 175.42 3mfw n ASP 61 N 6.00 -1.11 -4.85 -1.22 2.03 -1.26 -4.99 116.55 111.15 3mfw n ASP 61 Ca 0.11 -2.96 -0.32 0.00 0.52 0.00 0.00 54.79 52.14 3mfw n ASP 61 Cb 0.47 0.41 -0.03 0.00 -0.72 0.00 0.00 41.12 41.25 3mfw n ASP 61 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 3mfw s SER 62 N -1.42 6.55 0.73 1.67 0.01 -1.26 -4.32 113.70 115.67 3mfw s SER 62 Ca 0.34 1.45 -0.16 0.00 1.31 0.00 0.00 55.95 58.89 3mfw s SER 62 Cb 0.20 -2.46 0.02 0.00 0.21 0.00 0.00 66.02 63.99 3mfw s SER 62 CO -0.17 -0.58 1.01 -2.65 0.41 0.00 0.00 173.24 171.27 3mfw n PRO 63 N -1.66 0.50 -3.51 12.44 -0.02 -1.26 -4.68 135.00 136.80 3mfw n PRO 63 Ca 0.05 0.23 -0.42 0.00 -2.02 0.00 0.00 63.50 61.34 3mfw n PRO 63 Cb 0.54 -2.27 -0.10 0.00 -0.02 0.00 0.00 33.50 31.65 3mfw n PRO 63 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 3mfw s PHE 64 N -1.83 3.25 0.00 6.00 5.36 0.32 -4.89 117.98 126.18 3mfw s PHE 64 Ca 0.74 -0.86 0.00 0.00 -0.96 0.00 0.00 56.93 55.84 3mfw s PHE 64 Cb -0.34 -2.65 0.00 0.00 -0.34 0.00 0.00 43.02 39.69 3mfw s PHE 64 CO 0.50 -0.67 0.00 1.04 -1.46 0.00 0.00 175.22 174.63 3mfw n GLN 65 N 5.09 0.00 -0.11 10.12 6.02 -1.26 -0.46 117.38 136.78 3mfw n GLN 65 Ca -0.11 0.00 0.07 0.00 -0.01 0.00 0.00 57.00 56.95 3mfw n GLN 65 Cb 0.46 0.00 0.13 0.00 1.02 0.00 0.00 30.24 31.84 3mfw n GLN 65 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.06 176.49 3mfw n ILE 66 N 0.00 0.46 -2.48 5.09 -5.35 -1.26 -4.95 119.36 110.87 3mfw n ILE 66 Ca 0.00 -0.73 -0.42 0.00 -0.27 0.00 0.00 62.75 61.32 3mfw n ILE 66 Cb 0.00 0.93 -0.03 0.00 -1.74 0.00 0.00 39.64 38.81 3mfw n ILE 66 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 3mfw s VAL 67 N -1.13 4.32 0.05 7.28 1.01 0.39 -4.32 120.40 128.02 3mfw s VAL 67 Ca 0.24 1.63 -0.11 0.00 0.00 0.00 0.00 61.98 63.74 3mfw s VAL 67 Cb 0.14 -4.05 -0.06 0.00 0.00 0.00 0.00 36.38 32.41 3mfw s VAL 67 CO 0.20 -0.03 0.40 -0.54 0.00 0.00 0.00 175.10 175.14 3mfw s LYS 68 N 2.40 3.81 -1.52 2.72 1.02 -0.53 -0.52 119.74 127.12 3mfw s LYS 68 Ca 0.55 0.25 -0.10 0.00 0.02 0.00 0.00 55.97 56.69 3mfw s LYS 68 Cb -0.23 -3.06 0.07 0.00 -0.52 0.00 0.00 37.83 34.09 3mfw s LYS 68 CO 0.20 0.60 0.73 0.09 -0.92 0.00 0.00 175.35 176.05 3mfw n ASN 69 N 1.19 -2.63 -0.16 2.83 3.02 -1.26 -4.60 115.26 113.65 3mfw n ASN 69 Ca -0.10 -0.92 -0.07 0.00 -0.03 0.00 0.00 54.58 53.46 3mfw n ASN 69 Cb 0.52 -3.34 0.08 0.00 -0.61 0.00 0.00 39.78 36.43 3mfw n ASN 69 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 3mfw h PRO 70 N -1.82 0.94 -0.19 3.52 0.13 -1.83 -1.16 132.00 131.59 3mfw h PRO 70 Ca -0.60 -0.30 -0.12 0.00 -0.87 0.00 0.00 66.00 64.11 3mfw h PRO 70 Cb 1.38 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.41 3mfw h PRO 70 CO 0.68 0.96 -0.40 0.00 -0.23 0.00 0.00 178.00 179.01 3mfw h ARG 71 N 0.86 0.44 -0.17 0.86 3.08 -1.89 0.15 114.38 117.71 3mfw h ARG 71 Ca 0.15 -0.21 -0.02 0.00 0.07 0.00 0.00 59.98 59.97 3mfw h ARG 71 Cb 0.57 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.61 3mfw h ARG 71 CO 0.03 0.76 0.04 0.77 -1.07 0.00 0.00 179.97 180.50 3mfw h SER 72 N 0.36 0.26 -0.30 7.04 0.02 -1.83 -0.76 113.55 118.35 3mfw h SER 72 Ca 0.03 -0.24 -0.05 0.00 -0.84 0.00 0.00 61.79 60.69 3mfw h SER 72 Cb 0.86 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.32 3mfw h SER 72 CO 0.07 0.43 -0.02 0.58 -1.14 0.00 0.00 176.83 176.76 3mfw h VAL 73 N 0.08 1.26 -0.55 2.27 2.07 -1.06 -0.57 116.25 119.76 3mfw h VAL 73 Ca 0.05 -0.99 -0.01 0.00 0.82 0.00 0.00 66.70 66.57 3mfw h VAL 73 Cb 0.28 1.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.33 3mfw h VAL 73 CO 0.00 0.32 0.30 1.23 0.02 0.00 0.00 177.57 179.44 3mfw h GLY 74 N 0.33 0.82 1.42 2.17 0.00 -0.69 -1.64 103.07 105.49 3mfw h GLY 74 Ca 0.08 -0.37 -0.16 0.00 0.00 0.00 0.00 47.33 46.88 3mfw h GLY 74 CO 0.02 0.36 -0.54 1.70 0.00 0.00 0.00 176.54 178.07 3mfw h LYS 75 N 0.73 0.61 -0.80 4.80 1.63 -1.06 0.59 116.57 123.07 3mfw h LYS 75 Ca 0.19 -0.38 -0.03 0.00 -0.85 0.00 0.00 60.65 59.58 3mfw h LYS 75 Cb 0.05 0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 31.69 3mfw h LYS 75 CO -0.03 0.99 0.37 0.00 -3.45 0.00 0.00 179.45 177.33 3mfw h ALA 76 N 0.93 1.14 -0.41 5.00 0.00 -0.81 -0.52 119.26 124.59 3mfw h ALA 76 Ca 0.01 -0.16 -0.14 0.00 0.00 0.00 0.00 54.91 54.61 3mfw h ALA 76 Cb 1.09 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 3mfw h ALA 76 CO 0.11 0.64 -0.32 0.77 0.00 0.00 0.00 179.25 180.45 3mfw h SER 77 N 1.14 0.96 -0.61 0.00 0.02 -1.13 -0.13 113.55 113.81 3mfw h SER 77 Ca 0.27 -0.40 0.03 0.00 -0.84 0.00 0.00 61.79 60.85 3mfw h SER 77 Cb 0.14 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.37 3mfw h SER 77 CO -0.03 1.19 0.37 -0.08 -1.14 0.00 0.00 176.83 177.13 3mfw h GLU 78 N 0.76 0.71 -0.49 3.45 4.81 -0.33 0.50 114.58 123.99 3mfw h GLU 78 Ca 0.08 -0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 59.18 3mfw h GLU 78 Cb 0.89 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.09 3mfw h GLU 78 CO 0.08 0.47 -0.05 0.37 -0.73 0.00 0.00 179.01 179.15 3mfw h GLN 79 N 0.73 0.90 -0.25 1.92 4.15 -0.97 -2.27 115.11 119.31 3mfw h GLN 79 Ca 0.25 -0.31 -0.10 0.00 0.77 0.00 0.00 58.65 59.25 3mfw h GLN 79 Cb 0.03 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.64 3mfw h GLN 79 CO -0.11 0.96 -0.28 1.25 -1.93 0.00 0.00 178.83 178.72 3mfw h LEU 80 N 0.75 0.49 -0.49 -2.39 5.85 -0.73 -2.32 115.31 116.47 3mfw h LEU 80 Ca 0.13 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.68 3mfw h LEU 80 Cb 0.58 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.45 3mfw h LEU 80 CO 0.03 0.76 0.32 0.00 -0.34 0.00 0.00 178.44 179.21 3mfw h ALA 81 N 1.28 0.63 -0.59 1.25 0.00 -0.72 0.11 119.26 121.21 3mfw h ALA 81 Ca 0.06 -0.05 0.09 0.00 0.00 0.00 0.00 54.91 55.01 3mfw h ALA 81 Cb 0.71 -0.20 -0.07 0.00 0.00 0.00 0.00 17.79 18.23 3mfw h ALA 81 CO 0.05 0.09 0.22 0.78 0.00 0.00 0.00 179.25 180.39 3mfw h GLY 82 N 0.67 0.82 1.14 0.00 0.00 -0.94 -1.33 103.07 103.43 3mfw h GLY 82 Ca 0.18 -0.12 -0.24 0.00 0.00 0.00 0.00 47.33 47.16 3mfw h GLY 82 CO -0.04 -0.01 -0.89 1.70 0.00 0.00 0.00 176.54 177.30 3mfw h LYS 83 N 0.40 0.70 -0.82 4.80 1.63 -0.83 -2.27 116.57 120.18 3mfw h LYS 83 Ca 0.30 -0.68 -0.02 0.00 -0.85 0.00 0.00 60.65 59.40 3mfw h LYS 83 Cb 0.36 0.18 -0.04 0.00 -0.60 0.00 0.00 32.23 32.13 3mfw h LYS 83 CO -0.30 1.27 0.45 0.28 -3.45 0.00 0.00 179.45 177.70 3mfw h VAL 84 N 0.38 1.24 -0.32 2.00 2.07 -0.69 -0.92 116.25 120.01 3mfw h VAL 84 Ca -0.10 -0.60 -0.07 0.00 0.82 0.00 0.00 66.70 66.76 3mfw h VAL 84 Cb 1.55 0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.43 3mfw h VAL 84 CO 0.18 0.27 -0.10 0.00 0.02 0.00 0.00 177.57 177.93 3mfw h ALA 85 N 1.35 1.24 0.19 1.67 0.00 -1.07 -0.81 119.26 121.82 3mfw h ALA 85 Ca 0.29 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 3mfw h ALA 85 Cb 0.03 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.68 3mfw h ALA 85 CO -0.05 0.50 -0.09 1.49 0.00 0.00 0.00 179.25 181.10 3mfw h GLU 86 N 0.49 -0.24 -0.74 0.00 4.81 -0.80 0.48 114.58 118.59 3mfw h GLU 86 Ca 0.09 0.02 0.11 0.00 -0.13 0.00 0.00 59.36 59.45 3mfw h GLU 86 Cb 0.48 0.05 -0.08 0.00 0.63 0.00 0.00 28.75 29.83 3mfw h GLU 86 CO 0.03 -0.02 0.35 0.28 -0.73 0.00 0.00 179.01 178.92 3mfw h VAL 87 N -0.43 0.80 -0.56 0.32 2.07 -0.98 -0.79 116.25 116.68 3mfw h VAL 87 Ca -0.03 -0.20 -0.07 0.00 0.82 0.00 0.00 66.70 67.23 3mfw h VAL 87 Cb 0.33 0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 3mfw h VAL 87 CO 0.04 0.11 0.08 0.11 0.02 0.00 0.00 177.57 177.93 3mfw h LYS 88 N 0.58 0.94 0.00 1.57 1.79 -0.89 -2.06 116.57 118.50 3mfw h LYS 88 Ca 0.37 -0.26 -0.03 0.00 -2.18 0.00 0.00 60.65 58.55 3mfw h LYS 88 Cb 0.45 -0.11 -0.00 0.00 -1.58 0.00 0.00 32.23 30.99 3mfw h LYS 88 CO -0.30 0.91 -0.16 0.87 -1.08 0.00 0.00 179.45 179.69 3mfw h LYS 89 N 0.83 0.00 0.00 3.15 1.57 -0.02 -0.03 116.57 122.07 3mfw h LYS 89 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 3mfw h LYS 89 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.74 3mfw h LYS 89 CO 0.01 0.16 0.00 0.09 -0.57 0.00 0.00 179.45 179.14 3mfw n ASN 90 N -3.71 0.00 -0.97 0.86 4.13 -0.39 -4.89 115.26 110.29 3mfw n ASN 90 Ca -0.02 -1.14 -0.09 0.00 1.68 0.00 0.00 54.58 55.02 3mfw n ASN 90 Cb 0.27 0.00 -0.01 0.00 -1.54 0.00 0.00 39.78 38.51 3mfw n ASN 90 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3mfw n GLY 91 N 0.46 0.05 3.54 7.41 0.00 -0.03 -5.03 105.19 111.59 3mfw n GLY 91 Ca 0.11 -0.53 -0.25 0.00 0.00 0.00 0.00 46.02 45.34 3mfw n GLY 91 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3mfw s ARG 92 N -4.38 1.93 -0.10 1.61 0.52 -1.01 -4.67 118.95 112.85 3mfw s ARG 92 Ca 0.00 -1.45 -0.29 0.00 -0.52 0.00 0.00 55.73 53.46 3mfw s ARG 92 Cb 0.00 -2.02 -0.01 0.00 0.52 0.00 0.00 34.95 33.44 3mfw s ARG 92 CO 0.00 0.39 1.00 0.42 0.02 0.00 0.00 175.30 177.13 3mfw s ILE 93 N -1.99 4.79 0.19 1.52 1.01 0.67 -4.21 121.20 123.17 3mfw s ILE 93 Ca 0.27 2.04 -0.30 0.00 0.00 0.00 0.00 60.65 62.65 3mfw s ILE 93 Cb -0.07 -4.31 -0.08 0.00 0.01 0.00 0.00 42.46 38.01 3mfw s ILE 93 CO 0.15 0.01 1.00 -0.94 0.00 0.00 0.00 174.94 175.17 3mfw s SER 94 N 1.09 7.47 -0.29 3.58 1.04 -1.11 -0.22 113.70 125.27 3mfw s SER 94 Ca 0.48 1.97 0.01 0.00 0.48 0.00 0.00 55.95 58.89 3mfw s SER 94 Cb -0.18 -2.60 0.09 0.00 0.10 0.00 0.00 66.02 63.42 3mfw s SER 94 CO 0.18 -0.03 0.04 -0.22 0.98 0.00 0.00 173.24 174.19 3mfw s LEU 95 N -0.66 2.84 -0.22 2.42 0.20 -0.23 -0.59 118.68 122.44 3mfw s LEU 95 Ca 0.45 -1.58 -0.18 0.00 0.69 0.00 0.00 54.13 53.52 3mfw s LEU 95 Cb -0.27 -1.11 -0.03 0.00 -0.43 0.00 0.00 46.19 44.35 3mfw s LEU 95 CO 0.33 -0.35 0.48 -0.69 -0.29 0.00 0.00 176.35 175.83 3mfw s VAL 96 N 1.41 5.12 -0.33 1.68 1.01 0.39 -0.87 120.40 128.80 3mfw s VAL 96 Ca 0.05 0.86 -0.15 0.00 0.00 0.00 0.00 61.98 62.74 3mfw s VAL 96 Cb -0.18 -3.81 -0.02 0.00 0.00 0.00 0.00 36.38 32.38 3mfw s VAL 96 CO -0.15 0.16 0.36 -0.76 0.00 0.00 0.00 175.10 174.71 3mfw s LEU 97 N 1.81 4.36 0.00 3.92 1.43 0.15 -0.97 118.68 129.38 3mfw s LEU 97 Ca 0.22 -0.14 0.04 0.00 -1.03 0.00 0.00 54.13 53.21 3mfw s LEU 97 Cb -0.15 -2.35 0.09 0.00 0.03 0.00 0.00 46.19 43.81 3mfw s LEU 97 CO 0.09 -0.31 0.66 0.61 0.23 0.00 0.00 176.35 177.64 3mfw n GLY 98 N 4.92 1.39 0.00 -3.19 0.00 -0.01 -0.93 105.19 107.37 3mfw n GLY 98 Ca -0.09 -2.12 0.00 0.00 0.00 0.00 0.00 46.02 43.81 3mfw n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mfw n GLY 99 N -0.44 0.18 3.91 -0.02 0.00 -0.12 -3.33 105.19 105.37 3mfw n GLY 99 Ca 0.12 -1.55 -0.28 0.00 0.00 0.00 0.00 46.02 44.32 3mfw n GLY 99 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3mfw s ASP 100 N -1.16 5.65 0.00 1.61 1.47 -0.62 -1.04 116.67 122.57 3mfw s ASP 100 Ca 0.00 0.87 0.21 0.00 1.18 0.00 0.00 52.55 54.80 3mfw s ASP 100 Cb 0.00 -1.84 1.09 0.00 -0.34 0.00 0.00 42.92 41.82 3mfw s ASP 100 CO 0.00 -1.08 1.64 1.57 0.68 0.00 0.00 175.17 177.98 3mfw n HIS 101 N -2.67 0.00 0.28 2.11 -0.00 -1.26 -2.39 115.22 111.29 3mfw n HIS 101 Ca 0.05 0.00 0.14 0.00 -0.00 0.00 0.00 57.72 57.90 3mfw n HIS 101 Cb 0.57 -0.21 0.81 0.00 -0.00 0.00 0.00 29.99 31.16 3mfw n HIS 101 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 3mfw h SER 102 N 0.00 0.00 0.03 0.26 4.64 -1.79 -1.84 113.55 114.85 3mfw h SER 102 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3mfw h SER 102 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 3mfw h SER 102 CO 0.00 0.06 0.00 -0.07 -0.87 0.00 0.00 176.83 175.95 3mfw h LEU 103 N 0.00 0.00 -2.30 5.97 3.38 -1.84 -1.91 115.31 118.61 3mfw h LEU 103 Ca -0.00 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.98 3mfw h LEU 103 Cb 0.16 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 3mfw h LEU 103 CO 0.01 0.00 0.04 0.00 0.09 0.00 0.00 178.44 178.58 3mfw h ALA 104 N 2.00 1.72 -0.53 1.53 0.00 -1.57 0.14 119.26 122.55 3mfw h ALA 104 Ca 0.00 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.94 3mfw h ALA 104 Cb 0.02 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 3mfw h ALA 104 CO 0.00 -0.06 0.30 0.82 0.00 0.00 0.00 179.25 180.31 3mfw h ILE 105 N 0.00 1.01 -0.07 0.00 2.04 -1.56 -0.70 117.51 118.23 3mfw h ILE 105 Ca 0.02 -0.20 -0.23 0.00 1.00 0.00 0.00 64.86 65.45 3mfw h ILE 105 Cb 0.09 0.38 0.01 0.00 -0.74 0.00 0.00 36.82 36.56 3mfw h ILE 105 CO -0.00 0.11 -0.86 1.23 0.00 0.00 0.00 178.15 178.62 3mfw h GLY 106 N 0.58 0.67 0.86 5.37 0.00 -1.28 -1.65 103.07 107.62 3mfw h GLY 106 Ca 0.22 -1.04 -0.03 0.00 0.00 0.00 0.00 47.33 46.48 3mfw h GLY 106 CO -0.12 0.92 0.04 0.23 0.00 0.00 0.00 176.54 177.61 3mfw h SER 107 N 0.38 0.38 -0.27 0.19 0.87 -0.56 -0.39 113.55 114.15 3mfw h SER 107 Ca -0.07 -0.26 -0.18 0.00 -1.23 0.00 0.00 61.79 60.05 3mfw h SER 107 Cb 1.49 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 63.35 3mfw h SER 107 CO 0.16 0.55 -0.53 0.40 -0.53 0.00 0.00 176.83 176.88 3mfw h ILE 108 N 0.20 1.28 -0.26 2.23 2.04 -1.21 -1.40 117.51 120.39 3mfw h ILE 108 Ca 0.07 -1.72 0.05 0.00 1.00 0.00 0.00 64.86 64.27 3mfw h ILE 108 Cb 0.33 1.69 -0.05 0.00 -0.74 0.00 0.00 36.82 38.04 3mfw h ILE 108 CO 0.00 0.56 -0.07 0.28 0.00 0.00 0.00 178.15 178.92 3mfw h SER 109 N 0.59 -0.26 -0.40 1.72 0.02 -1.19 0.07 113.55 114.11 3mfw h SER 109 Ca 0.01 0.08 -0.05 0.00 -0.84 0.00 0.00 61.79 60.99 3mfw h SER 109 Cb 1.14 0.17 -0.02 0.00 0.14 0.00 0.00 62.40 63.83 3mfw h SER 109 CO 0.12 -0.09 0.04 1.23 -1.14 0.00 0.00 176.83 176.99 3mfw h GLY 110 N -0.01 0.73 0.68 -3.77 0.00 -1.06 -1.88 103.07 97.76 3mfw h GLY 110 Ca 0.13 -0.50 0.04 0.00 0.00 0.00 0.00 47.33 47.00 3mfw h GLY 110 CO -0.28 0.47 0.13 0.84 0.00 0.00 0.00 176.54 177.70 3mfw h HIS 111 N 0.52 0.23 0.00 5.60 6.17 -0.92 -2.38 115.15 124.37 3mfw h HIS 111 Ca 0.12 0.02 -0.01 0.00 0.71 0.00 0.00 60.37 61.21 3mfw h HIS 111 Cb 0.41 -0.05 -0.00 0.00 2.52 0.00 0.00 27.41 30.28 3mfw h HIS 111 CO 0.03 0.10 -0.05 0.00 0.71 0.00 0.00 177.93 178.71 3mfw h ALA 112 N 1.24 1.10 -0.24 5.26 0.00 -0.74 0.12 119.26 126.01 3mfw h ALA 112 Ca 0.17 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 3mfw h ALA 112 Cb 0.15 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3mfw h ALA 112 CO -0.17 0.07 -0.02 0.00 0.00 0.00 0.00 179.25 179.12 3mfw h ARG 113 N 0.00 0.35 0.01 0.00 3.08 -0.79 -2.37 114.38 114.66 3mfw h ARG 113 Ca -0.00 -0.07 -0.35 0.00 0.07 0.00 0.00 59.98 59.64 3mfw h ARG 113 Cb 0.32 -0.06 -0.06 0.00 0.08 0.00 0.00 29.97 30.26 3mfw h ARG 113 CO 0.01 0.40 -2.12 0.28 -1.07 0.00 0.00 179.97 177.47 3mfw n VAL 114 N -4.32 1.52 -3.60 2.04 0.31 -0.72 -4.70 118.33 108.86 3mfw n VAL 114 Ca 0.00 -0.78 -0.27 0.00 -0.01 0.00 0.00 64.34 63.28 3mfw n VAL 114 Cb 0.22 -0.92 -0.11 0.00 -0.91 0.00 0.00 33.84 32.12 3mfw n VAL 114 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 3mfw n HIS 115 N -3.00 0.79 0.19 3.52 8.25 0.35 -4.98 115.22 120.34 3mfw n HIS 115 Ca -0.29 -3.72 0.08 0.00 -0.26 0.00 0.00 57.72 53.53 3mfw n HIS 115 Cb 1.09 -0.10 0.39 0.00 1.12 0.00 0.00 29.99 32.49 3mfw n HIS 115 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 3mfw n PRO 116 N 2.47 0.10 -0.28 -0.41 -0.04 -0.90 -2.18 135.00 133.76 3mfw n PRO 116 Ca 0.26 0.53 0.09 0.00 -0.04 0.00 0.00 63.50 64.34 3mfw n PRO 116 Cb 0.43 -1.78 0.25 0.00 -0.04 0.00 0.00 33.50 32.36 3mfw n PRO 116 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 3mfw n ASP 117 N -1.99 3.00 -4.70 3.54 5.75 -1.26 -4.98 116.55 115.92 3mfw n ASP 117 Ca -0.00 -1.99 -0.33 0.00 -0.01 0.00 0.00 54.79 52.46 3mfw n ASP 117 Cb 0.07 -0.36 0.13 0.00 -1.03 0.00 0.00 41.12 39.92 3mfw n ASP 117 CO 0.00 0.00 0.00 -1.48 -0.11 0.00 0.00 177.20 175.61 3mfw s LEU 118 N -1.04 3.14 0.09 -2.12 0.05 -0.93 -4.52 118.68 113.35 3mfw s LEU 118 Ca 0.38 2.36 0.09 0.00 0.05 0.00 0.00 54.13 57.01 3mfw s LEU 118 Cb 0.20 -4.59 -0.03 0.00 -2.05 0.00 0.00 46.19 39.72 3mfw s LEU 118 CO 0.26 -2.67 -0.24 -0.83 -0.55 0.00 0.00 176.35 172.32 3mfw s GLY 119 N -2.17 1.36 -0.10 -3.48 0.00 0.11 -4.95 107.32 98.10 3mfw s GLY 119 Ca 0.73 -1.29 0.01 0.00 0.00 0.00 0.00 44.72 44.18 3mfw s GLY 119 CO 0.51 -1.24 -0.13 0.14 0.00 0.00 0.00 173.10 172.37 3mfw s VAL 120 N -0.98 3.08 -0.18 1.40 1.01 0.12 -0.29 120.40 124.57 3mfw s VAL 120 Ca 0.10 -0.68 -0.04 0.00 0.00 0.00 0.00 61.98 61.37 3mfw s VAL 120 Cb -0.10 -2.26 -0.02 0.00 0.00 0.00 0.00 36.38 34.00 3mfw s VAL 120 CO 0.04 0.55 -0.03 -0.63 0.00 0.00 0.00 175.10 175.03 3mfw s ILE 121 N -0.11 3.75 -0.25 2.22 1.01 -0.07 -0.69 121.20 127.06 3mfw s ILE 121 Ca -0.01 -0.39 0.03 0.00 0.00 0.00 0.00 60.65 60.27 3mfw s ILE 121 Cb -0.14 -2.67 0.06 0.00 0.01 0.00 0.00 42.46 39.72 3mfw s ILE 121 CO 0.03 0.46 -0.12 0.86 0.00 0.00 0.00 174.94 176.18 3mfw s TRP 122 N 0.76 3.22 -0.26 3.97 -0.11 0.61 -0.38 118.94 126.74 3mfw s TRP 122 Ca -0.01 -2.25 -0.07 0.00 1.22 0.00 0.00 56.10 54.98 3mfw s TRP 122 Cb -0.14 -1.93 -0.02 0.00 -1.50 0.00 0.00 33.47 29.87 3mfw s TRP 122 CO 0.02 -0.87 0.08 0.08 -4.62 0.00 0.00 176.95 171.63 3mfw s VAL 123 N 1.12 4.28 -0.26 5.86 1.01 -0.32 -0.98 120.40 131.12 3mfw s VAL 123 Ca -0.07 -0.26 -0.29 0.00 0.00 0.00 0.00 61.98 61.36 3mfw s VAL 123 Cb -0.19 -3.04 0.17 0.00 0.00 0.00 0.00 36.38 33.32 3mfw s VAL 123 CO -0.06 0.29 1.27 -0.62 0.00 0.00 0.00 175.10 175.98 3mfw s ASP 124 N 1.60 -0.13 0.51 3.32 -1.08 -0.76 -0.94 116.67 119.19 3mfw s ASP 124 Ca 0.06 0.16 0.28 0.00 -0.52 0.00 0.00 52.55 52.53 3mfw s ASP 124 Cb -0.15 0.13 1.31 0.00 -1.46 0.00 0.00 42.92 42.74 3mfw s ASP 124 CO 0.04 -0.11 1.99 0.00 0.52 0.00 0.00 175.17 177.60 3mfw h ALA 125 N 2.34 1.12 -3.29 3.66 0.00 -1.71 -2.78 119.26 118.61 3mfw h ALA 125 Ca -0.13 -0.12 -0.65 0.00 0.00 0.00 0.00 54.91 54.01 3mfw h ALA 125 Cb 1.18 -0.02 -0.16 0.00 0.00 0.00 0.00 17.79 18.79 3mfw h ALA 125 CO 0.24 0.17 -0.76 -1.01 0.00 0.00 0.00 179.25 177.88 3mfw s HIS 126 N -3.91 2.57 -0.42 0.00 3.76 -1.26 -0.59 115.29 115.44 3mfw s HIS 126 Ca -0.01 -0.25 0.23 0.00 -0.15 0.00 0.00 55.06 54.89 3mfw s HIS 126 Cb 0.11 -1.30 0.22 0.00 1.11 0.00 0.00 32.58 32.73 3mfw s HIS 126 CO 0.58 0.47 1.31 1.79 -0.85 0.00 0.00 174.74 178.04 3mfw h THR 127 N 3.09 0.00 -5.86 1.30 1.35 -1.89 -3.48 112.91 107.42 3mfw h THR 127 Ca -0.48 -0.85 -0.44 0.00 -0.55 0.00 0.00 66.41 64.09 3mfw h THR 127 Cb 1.19 1.53 -0.02 0.00 -1.73 0.00 0.00 68.15 69.12 3mfw h THR 127 CO 0.51 0.00 -0.69 0.47 -0.25 0.00 0.00 175.52 175.56 3mfw n ASP 128 N -2.63 -4.88 -0.07 5.36 8.00 -1.26 -4.74 116.55 116.33 3mfw n ASP 128 Ca 0.02 -0.62 0.06 0.00 0.71 0.00 0.00 54.79 54.96 3mfw n ASP 128 Cb 0.51 -3.92 0.08 0.00 -0.02 0.00 0.00 41.12 37.77 3mfw n ASP 128 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3mfw n ILE 129 N -4.53 1.44 -1.83 0.53 3.06 -1.15 -1.02 119.36 115.86 3mfw n ILE 129 Ca 0.01 -1.66 -0.34 0.00 -2.50 0.00 0.00 62.75 58.26 3mfw n ILE 129 Cb 0.54 0.08 0.05 0.00 0.54 0.00 0.00 39.64 40.85 3mfw n ILE 129 CO 0.00 0.00 0.00 0.20 -2.50 0.00 0.00 176.55 174.25 3mfw s ASN 130 N -2.07 5.04 0.51 9.51 0.01 -0.70 -4.37 114.94 122.86 3mfw s ASN 130 Ca 0.19 2.17 0.04 0.00 -0.71 0.00 0.00 52.86 54.55 3mfw s ASN 130 Cb 0.16 -2.57 0.03 0.00 0.41 0.00 0.00 41.25 39.28 3mfw s ASN 130 CO 0.02 -1.68 0.71 0.42 -1.51 0.00 0.00 177.10 175.05 3mfw s THR 131 N -2.03 2.78 0.60 1.60 -4.23 -1.26 -4.23 115.64 108.86 3mfw s THR 131 Ca 0.71 -0.78 0.30 0.00 -1.18 0.00 0.00 61.69 60.75 3mfw s THR 131 Cb -0.25 -3.00 0.30 0.00 1.34 0.00 0.00 72.50 70.90 3mfw s THR 131 CO 0.38 -0.00 1.92 -0.65 -0.54 0.00 0.00 174.62 175.73 3mfw h PRO 132 N 0.26 0.00 0.00 3.99 0.11 -1.93 -1.16 132.00 133.27 3mfw h PRO 132 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 3mfw h PRO 132 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 3mfw h PRO 132 CO 0.50 0.00 -1.75 1.28 -0.21 0.00 0.00 178.00 177.82 3mfw n LEU 133 N -2.83 0.12 0.02 2.35 4.77 -1.26 -4.33 117.00 115.85 3mfw n LEU 133 Ca -0.02 -0.07 0.11 0.00 -0.03 0.00 0.00 56.01 56.00 3mfw n LEU 133 Cb 0.33 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.33 3mfw n LEU 133 CO 0.13 0.03 -0.40 0.35 -1.33 0.00 0.00 177.39 176.18 3mfw n THR 134 N -2.07 0.17 -1.76 -5.08 -2.24 -0.99 -4.93 114.28 97.37 3mfw n THR 134 Ca -0.03 -0.43 -0.41 0.00 -2.27 0.00 0.00 64.05 60.92 3mfw n THR 134 Cb 0.48 0.04 0.01 0.00 -2.10 0.00 0.00 70.33 68.75 3mfw n THR 134 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 3mfw n THR 135 N -2.24 2.27 -0.03 4.28 5.66 -0.47 -4.86 114.28 118.88 3mfw n THR 135 Ca -0.01 -0.50 0.02 0.00 -3.05 0.00 0.00 64.05 60.51 3mfw n THR 135 Cb 0.52 -1.86 -0.13 0.00 -1.55 0.00 0.00 70.33 67.32 3mfw n THR 135 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 3mfw n THR 136 N 0.18 0.40 0.01 1.09 -2.24 -1.26 -4.60 114.28 107.87 3mfw n THR 136 Ca 0.03 -0.49 -0.10 0.00 -2.27 0.00 0.00 64.05 61.23 3mfw n THR 136 Cb 0.39 -0.15 -0.13 0.00 -2.10 0.00 0.00 70.33 68.34 3mfw n THR 136 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3mfw h SER 137 N 0.00 0.06 0.00 3.42 4.64 -1.94 -3.48 113.55 116.25 3mfw h SER 137 Ca -0.16 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 3mfw h SER 137 Cb 1.22 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 3mfw h SER 137 CO 0.01 1.09 0.00 0.61 -0.87 0.00 0.00 176.83 177.66 3mfw n GLY 138 N 1.53 1.33 3.69 -0.77 0.00 -1.26 -4.90 105.19 104.81 3mfw n GLY 138 Ca -0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.47 3mfw n GLY 138 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3mfw s ASN 139 N -3.17 7.22 0.22 1.61 0.01 -1.26 -1.45 114.94 118.11 3mfw s ASN 139 Ca 0.00 1.50 0.24 0.00 -0.71 0.00 0.00 52.86 53.89 3mfw s ASN 139 Cb 0.00 -2.54 0.91 0.00 0.41 0.00 0.00 41.25 40.03 3mfw s ASN 139 CO 0.00 -0.41 1.73 0.18 -1.51 0.00 0.00 177.10 177.10 3mfw n LEU 140 N 4.84 0.66 0.00 0.60 4.77 -0.47 -1.66 117.00 125.74 3mfw n LEU 140 Ca 0.08 0.62 0.08 0.00 -0.03 0.00 0.00 56.01 56.75 3mfw n LEU 140 Cb 0.49 -0.48 0.36 0.00 -2.33 0.00 0.00 43.42 41.46 3mfw n LEU 140 CO 0.51 -0.38 0.75 0.00 -1.33 0.00 0.00 177.39 176.94 3mfw n HIS 141 N -2.18 0.00 0.09 -1.77 1.44 0.19 -1.59 115.22 111.41 3mfw n HIS 141 Ca 0.04 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.86 3mfw n HIS 141 Cb 0.30 -0.46 0.24 0.00 0.12 0.00 0.00 29.99 30.19 3mfw n HIS 141 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3mfw n GLY 142 N 0.16 1.97 0.00 -1.39 0.00 -0.66 -4.48 105.19 100.79 3mfw n GLY 142 Ca 0.05 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.32 3mfw n GLY 142 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3mfw n GLN 143 N 1.52 0.01 -0.26 1.61 6.02 -0.62 -1.72 117.38 123.94 3mfw n GLN 143 Ca 0.21 -0.39 0.02 0.00 -0.01 0.00 0.00 57.00 56.83 3mfw n GLN 143 Cb 0.61 -0.88 0.24 0.00 1.02 0.00 0.00 30.24 31.23 3mfw n GLN 143 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 3mfw h PRO 144 N 0.00 0.99 -0.04 -1.09 0.13 -1.49 -2.17 132.00 128.33 3mfw h PRO 144 Ca 0.00 -0.06 -0.07 0.00 -0.87 0.00 0.00 66.00 65.00 3mfw h PRO 144 Cb 0.05 -0.22 -0.01 0.00 0.13 0.00 0.00 31.00 30.94 3mfw h PRO 144 CO 0.00 0.66 -0.31 0.28 -0.23 0.00 0.00 178.00 178.40 3mfw h VAL 145 N 1.02 1.24 0.00 1.56 2.07 -1.37 -1.85 116.25 118.93 3mfw h VAL 145 Ca 0.33 -1.15 -0.04 0.00 0.82 0.00 0.00 66.70 66.66 3mfw h VAL 145 Cb 0.03 1.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 3mfw h VAL 145 CO -0.09 0.34 -0.17 0.77 0.02 0.00 0.00 177.57 178.43 3mfw h SER 146 N 0.07 0.00 1.45 0.57 4.64 -1.55 -1.01 113.55 117.73 3mfw h SER 146 Ca 0.01 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.28 3mfw h SER 146 Cb 0.59 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.68 3mfw h SER 146 CO 0.04 0.17 -0.23 -0.26 -0.87 0.00 0.00 176.83 175.69 3mfw h PHE 147 N 0.00 0.00 0.00 4.77 -1.00 -1.40 -3.29 116.94 116.03 3mfw h PHE 147 Ca -0.00 0.00 -0.07 0.00 2.81 0.00 0.00 57.97 60.71 3mfw h PHE 147 Cb 0.36 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.91 3mfw h PHE 147 CO 0.00 0.23 -1.37 1.28 -1.61 0.00 0.00 178.31 176.84 3mfw n LEU 148 N -3.22 0.68 -4.71 1.54 4.77 -0.44 -4.13 117.00 111.48 3mfw n LEU 148 Ca 0.02 0.28 -0.41 0.00 -0.03 0.00 0.00 56.01 55.87 3mfw n LEU 148 Cb 0.55 0.02 -0.04 0.00 -2.33 0.00 0.00 43.42 41.62 3mfw n LEU 148 CO 0.35 -0.02 0.57 -0.76 -1.33 0.00 0.00 177.39 176.21 3mfw s LEU 149 N -5.37 4.36 0.26 2.23 1.43 -0.87 -1.27 118.68 119.45 3mfw s LEU 149 Ca -0.03 1.48 -0.04 0.00 -1.03 0.00 0.00 54.13 54.51 3mfw s LEU 149 Cb 0.10 -3.38 0.31 0.00 0.03 0.00 0.00 46.19 43.25 3mfw s LEU 149 CO 0.82 -0.19 1.83 0.11 0.23 0.00 0.00 176.35 179.15 3mfw h LYS 150 N 6.72 1.01 0.00 1.70 1.57 -1.05 -2.37 116.57 124.15 3mfw h LYS 150 Ca -0.41 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.19 3mfw h LYS 150 Cb 1.21 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.35 3mfw h LYS 150 CO 0.75 0.83 0.00 0.93 -0.57 0.00 0.00 179.45 181.39 3mfw h GLU 151 N 0.99 0.00 -0.31 3.15 3.07 -1.93 -1.85 114.58 117.72 3mfw h GLU 151 Ca 0.23 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.09 3mfw h GLU 151 Cb 0.20 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.11 3mfw h GLU 151 CO -0.02 0.00 0.00 1.28 -1.40 0.00 0.00 179.01 178.87 3mfw n LEU 152 N -2.82 3.23 -4.73 1.33 4.32 -0.89 -4.85 117.00 112.58 3mfw n LEU 152 Ca -0.03 -1.43 -0.42 0.00 -0.02 0.00 0.00 56.01 54.12 3mfw n LEU 152 Cb 0.06 -0.19 -0.03 0.00 -1.62 0.00 0.00 43.42 41.64 3mfw n LEU 152 CO 0.17 0.68 1.05 -1.59 -1.22 0.00 0.00 177.39 176.47 3mfw s LYS 153 N -1.45 4.33 0.00 3.23 0.00 -0.70 -0.14 119.74 125.02 3mfw s LYS 153 Ca 0.34 2.12 0.00 0.00 0.00 0.00 0.00 55.97 58.43 3mfw s LYS 153 Cb 0.20 -3.20 0.00 0.00 0.00 0.00 0.00 37.83 34.84 3mfw s LYS 153 CO 0.28 -0.37 0.00 0.41 0.00 0.00 0.00 175.35 175.67 3mfw n GLY 154 N 2.83 2.37 0.87 0.59 0.00 -1.26 -4.89 105.19 105.71 3mfw n GLY 154 Ca 0.09 -0.44 0.11 0.00 0.00 0.00 0.00 46.02 45.78 3mfw n GLY 154 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3mfw n LYS 155 N 0.00 2.06 -3.80 1.61 4.76 0.80 -4.84 118.16 118.75 3mfw n LYS 155 Ca 0.00 -1.78 -0.37 0.00 -2.87 0.00 0.00 58.31 53.30 3mfw n LYS 155 Cb 0.00 -1.43 -0.13 0.00 -1.84 0.00 0.00 35.03 31.63 3mfw n LYS 155 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3mfw s ILE 156 N -1.90 3.71 1.06 -0.18 -1.09 -1.17 -4.76 121.20 116.88 3mfw s ILE 156 Ca 0.26 -0.83 -0.12 0.00 -2.23 0.00 0.00 60.65 57.73 3mfw s ILE 156 Cb 0.19 -2.94 0.23 0.00 -1.58 0.00 0.00 42.46 38.35 3mfw s ILE 156 CO 0.30 0.07 1.06 -2.16 -1.23 0.00 0.00 174.94 172.98 3mfw s PRO 157 N 1.45 -0.11 -0.93 2.79 0.04 -1.26 -4.89 135.00 132.08 3mfw s PRO 157 Ca 0.01 0.87 -0.24 0.00 0.04 0.00 0.00 61.00 61.68 3mfw s PRO 157 Cb -0.17 -1.65 0.01 0.00 0.04 0.00 0.00 34.50 32.73 3mfw s PRO 157 CO 0.01 -3.19 1.61 -0.51 0.04 0.00 0.00 177.00 174.96 3mfw s ASP 158 N -2.85 5.99 -0.04 6.66 1.01 -1.26 -4.97 116.67 121.22 3mfw s ASP 158 Ca 0.67 -1.02 -0.28 0.00 0.71 0.00 0.00 52.55 52.63 3mfw s ASP 158 Cb -0.22 -2.56 -0.03 0.00 1.01 0.00 0.00 42.92 41.11 3mfw s ASP 158 CO 0.61 -1.96 0.89 -0.69 0.21 0.00 0.00 175.17 174.23 3mfw s VAL 159 N 6.82 4.91 0.23 -1.27 1.01 -1.26 -5.00 120.40 125.84 3mfw s VAL 159 Ca 0.53 1.86 -0.31 0.00 0.00 0.00 0.00 61.98 64.06 3mfw s VAL 159 Cb -0.03 -4.23 -0.11 0.00 0.00 0.00 0.00 36.38 32.00 3mfw s VAL 159 CO -0.03 0.17 1.62 -2.84 0.00 0.00 0.00 175.10 174.02 3mfw s PRO 160 N 1.09 4.16 0.00 2.72 0.02 -1.26 -1.66 135.00 140.06 3mfw s PRO 160 Ca 0.47 2.51 0.00 0.00 0.02 0.00 0.00 61.00 64.00 3mfw s PRO 160 Cb -0.20 -3.08 0.00 0.00 0.02 0.00 0.00 34.50 31.24 3mfw s PRO 160 CO 0.24 -0.65 0.00 0.41 -0.33 0.00 0.00 177.00 176.66 3mfw n GLY 161 N 3.22 1.49 0.33 0.52 0.00 -1.26 -3.25 105.19 106.23 3mfw n GLY 161 Ca 0.12 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.23 3mfw n GLY 161 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3mfw n PHE 162 N -1.34 0.30 0.30 1.61 3.01 -0.67 -3.96 117.46 116.71 3mfw n PHE 162 Ca 0.00 -0.93 0.16 0.00 1.01 0.00 0.00 57.45 57.69 3mfw n PHE 162 Cb 0.00 -0.19 0.74 0.00 -0.01 0.00 0.00 39.48 40.02 3mfw n PHE 162 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 3mfw h SER 163 N 0.60 0.00 1.52 4.37 4.64 -1.92 -1.76 113.55 121.00 3mfw h SER 163 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3mfw h SER 163 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 3mfw h SER 163 CO 0.07 0.00 0.00 4.11 -0.87 0.00 0.00 176.83 180.14 3mfw h TRP 164 N 0.00 0.00 -3.46 4.77 5.08 -1.97 -3.46 115.95 116.91 3mfw h TRP 164 Ca 0.00 0.00 -0.52 0.00 1.08 0.00 0.00 58.89 59.45 3mfw h TRP 164 Cb 0.25 0.00 0.02 0.00 -3.00 0.00 0.00 29.16 26.43 3mfw h TRP 164 CO 0.00 0.00 0.55 0.08 -1.28 0.00 0.00 178.44 177.79 3mfw s VAL 165 N -3.13 3.63 -0.13 0.12 1.01 -0.66 -5.03 120.40 116.20 3mfw s VAL 165 Ca 0.10 1.35 0.01 0.00 0.00 0.00 0.00 61.98 63.44 3mfw s VAL 165 Cb 0.11 -3.86 0.02 0.00 0.00 0.00 0.00 36.38 32.65 3mfw s VAL 165 CO 0.60 0.21 -0.15 -0.89 0.00 0.00 0.00 175.10 174.86 3mfw s THR 166 N 0.03 1.57 0.23 3.92 2.01 -1.26 -5.10 115.64 117.03 3mfw s THR 166 Ca 0.53 -0.66 -0.32 0.00 0.31 0.00 0.00 61.69 61.55 3mfw s THR 166 Cb -0.32 -1.45 -0.13 0.00 0.01 0.00 0.00 72.50 70.61 3mfw s THR 166 CO 0.36 0.46 1.45 -0.81 -0.69 0.00 0.00 174.62 175.39 3mfw n PRO 167 N 4.44 2.10 0.00 4.92 -0.04 -1.26 -4.88 135.00 140.28 3mfw n PRO 167 Ca -0.18 0.75 0.00 0.00 -0.04 0.00 0.00 63.50 64.03 3mfw n PRO 167 Cb 0.51 -2.44 0.00 0.00 -0.04 0.00 0.00 33.50 31.53 3mfw n PRO 167 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3mfw s ILE 169 N -0.38 0.84 0.25 0.00 -4.36 -0.87 -4.99 121.20 111.69 3mfw s ILE 169 Ca 0.00 -1.24 -0.00 0.00 -0.26 0.00 0.00 60.65 59.15 3mfw s ILE 169 Cb 0.00 -0.89 -0.04 0.00 1.25 0.00 0.00 42.46 42.78 3mfw s ILE 169 CO 0.00 -0.33 0.44 -0.44 0.24 0.00 0.00 174.94 174.85 3mfw s SER 170 N -1.74 6.36 0.45 4.36 0.01 -1.26 -0.44 113.70 121.44 3mfw s SER 170 Ca -0.05 0.40 0.20 0.00 1.31 0.00 0.00 55.95 57.81 3mfw s SER 170 Cb -0.09 -2.01 1.15 0.00 0.21 0.00 0.00 66.02 65.28 3mfw s SER 170 CO 0.01 -0.12 1.89 0.00 0.41 0.00 0.00 173.24 175.44 3mfw h ALA 171 N 1.61 2.29 0.00 1.44 0.00 -1.97 0.42 119.26 123.05 3mfw h ALA 171 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3mfw h ALA 171 Cb 1.20 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3mfw h ALA 171 CO 0.66 -0.54 0.00 0.36 0.00 0.00 0.00 179.25 179.73 3mfw n LYS 172 N -4.46 0.59 -0.47 0.00 2.85 -1.26 -3.50 118.16 111.91 3mfw n LYS 172 Ca 0.17 0.02 0.10 0.00 -1.05 0.00 0.00 58.31 57.55 3mfw n LYS 172 Cb 0.68 -1.50 0.32 0.00 -0.65 0.00 0.00 35.03 33.88 3mfw n LYS 172 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 3mfw n ASP 173 N -1.17 4.23 -4.15 -5.58 8.00 0.14 -4.93 116.55 113.09 3mfw n ASP 173 Ca 0.16 -2.25 -0.22 0.00 0.71 0.00 0.00 54.79 53.19 3mfw n ASP 173 Cb 0.17 -0.51 -0.14 0.00 -0.02 0.00 0.00 41.12 40.62 3mfw n ASP 173 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 3mfw s ILE 174 N -1.46 1.23 -0.05 0.53 2.07 -1.23 0.16 121.20 122.45 3mfw s ILE 174 Ca 0.47 -0.90 0.04 0.00 -1.41 0.00 0.00 60.65 58.85 3mfw s ILE 174 Cb 0.28 -1.07 0.00 0.00 0.13 0.00 0.00 42.46 41.80 3mfw s ILE 174 CO 0.27 0.16 -0.16 -0.69 -1.91 0.00 0.00 174.94 172.61 3mfw s VAL 175 N -0.65 1.36 0.03 4.00 1.01 0.14 -4.10 120.40 122.19 3mfw s VAL 175 Ca 0.04 -0.66 -0.09 0.00 0.00 0.00 0.00 61.98 61.27 3mfw s VAL 175 Cb -0.07 -1.19 -0.05 0.00 0.00 0.00 0.00 36.38 35.07 3mfw s VAL 175 CO 0.01 0.40 0.35 -0.31 0.00 0.00 0.00 175.10 175.54 3mfw s TYR 176 N 0.20 3.61 -0.04 5.22 2.02 -1.05 -0.29 117.35 127.02 3mfw s TYR 176 Ca -0.07 0.74 0.01 0.00 -0.37 0.00 0.00 57.07 57.38 3mfw s TYR 176 Cb -0.13 -2.11 0.02 0.00 -0.40 0.00 0.00 41.96 39.34 3mfw s TYR 176 CO 0.03 0.58 -0.02 0.42 -1.57 0.00 0.00 175.55 174.99 3mfw s ILE 177 N -1.29 0.32 0.00 2.71 1.01 -0.15 -0.46 121.20 123.34 3mfw s ILE 177 Ca 0.29 0.01 0.00 0.00 0.00 0.00 0.00 60.65 60.94 3mfw s ILE 177 Cb -0.14 -0.39 0.00 0.00 0.01 0.00 0.00 42.46 41.93 3mfw s ILE 177 CO 0.16 0.18 0.00 0.61 0.00 0.00 0.00 174.94 175.89 3mfw n GLY 178 N 4.15 1.20 3.75 6.18 0.00 -0.23 -1.83 105.19 118.40 3mfw n GLY 178 Ca -0.25 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.36 3mfw n GLY 178 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3mfw s LEU 179 N 0.00 4.37 0.00 0.99 1.43 -1.05 -4.07 118.68 120.36 3mfw s LEU 179 Ca 0.00 2.80 0.00 0.00 -1.03 0.00 0.00 54.13 55.90 3mfw s LEU 179 Cb 0.00 -3.63 0.00 0.00 0.03 0.00 0.00 46.19 42.59 3mfw s LEU 179 CO 0.00 -0.76 0.00 -2.11 0.23 0.00 0.00 176.35 173.71 3mfw n ARG 180 N 1.88 0.00 -3.36 1.70 1.85 0.24 -0.75 116.66 118.23 3mfw n ARG 180 Ca 0.06 0.00 -0.23 0.00 -1.00 0.00 0.00 57.85 56.67 3mfw n ARG 180 Cb 0.39 0.00 -0.09 0.00 -1.05 0.00 0.00 32.46 31.71 3mfw n ARG 180 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 3mfw s ASP 181 N 0.00 1.63 -0.14 2.89 -1.08 -0.31 -5.04 116.67 114.63 3mfw s ASP 181 Ca 0.00 -2.29 0.01 0.00 -0.52 0.00 0.00 52.55 49.75 3mfw s ASP 181 Cb 0.00 0.02 -0.01 0.00 -1.46 0.00 0.00 42.92 41.47 3mfw s ASP 181 CO 0.00 -0.23 -0.16 -0.69 0.52 0.00 0.00 175.17 174.61 3mfw s VAL 182 N 0.81 2.68 0.70 1.11 1.01 -1.26 -4.51 120.40 120.94 3mfw s VAL 182 Ca 0.24 -0.78 -0.12 0.00 0.00 0.00 0.00 61.98 61.32 3mfw s VAL 182 Cb -0.10 -2.11 0.01 0.00 0.00 0.00 0.00 36.38 34.18 3mfw s VAL 182 CO -0.07 0.53 1.07 -1.81 0.00 0.00 0.00 175.10 174.82 3mfw s ASP 183 N 0.57 5.16 0.18 3.32 1.01 -1.26 -4.80 116.67 120.84 3mfw s ASP 183 Ca -0.10 1.75 -0.14 0.00 0.71 0.00 0.00 52.55 54.78 3mfw s ASP 183 Cb -0.16 -2.51 0.12 0.00 1.01 0.00 0.00 42.92 41.38 3mfw s ASP 183 CO 0.04 -1.59 1.78 -0.65 0.21 0.00 0.00 175.17 174.95 3mfw h PRO 184 N -0.57 0.44 -0.38 8.23 0.11 -1.99 0.84 132.00 138.69 3mfw h PRO 184 Ca -0.44 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.58 3mfw h PRO 184 Cb 1.22 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 3mfw h PRO 184 CO 0.55 0.29 -0.02 0.78 -0.21 0.00 0.00 178.00 179.39 3mfw h GLY 185 N 0.46 0.65 0.95 -0.55 0.00 -1.93 -0.24 103.07 102.40 3mfw h GLY 185 Ca 0.21 -0.41 -0.02 0.00 0.00 0.00 0.00 47.33 47.11 3mfw h GLY 185 CO -0.16 0.38 0.18 0.83 0.00 0.00 0.00 176.54 177.77 3mfw h GLU 186 N 0.57 0.57 -0.80 4.80 5.08 -1.73 0.20 114.58 123.28 3mfw h GLU 186 Ca 0.12 -0.09 -0.03 0.00 -1.00 0.00 0.00 59.36 58.35 3mfw h GLU 186 Cb 0.40 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.51 3mfw h GLU 186 CO 0.02 0.52 0.38 1.25 -1.00 0.00 0.00 179.01 180.18 3mfw h HIS 187 N 0.49 1.15 -0.47 4.33 2.76 -0.20 -0.13 115.15 123.08 3mfw h HIS 187 Ca 0.13 -0.06 0.04 0.00 -2.20 0.00 0.00 60.37 58.29 3mfw h HIS 187 Cb 0.15 -0.36 -0.04 0.00 1.55 0.00 0.00 27.41 28.71 3mfw h HIS 187 CO -0.01 0.84 0.23 -0.92 -1.30 0.00 0.00 177.93 176.77 3mfw h TYR 188 N 1.13 0.41 -0.73 5.26 3.20 -0.69 -1.68 116.97 123.87 3mfw h TYR 188 Ca 0.27 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.14 3mfw h TYR 188 Cb 0.13 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.24 3mfw h TYR 188 CO 0.01 0.20 0.37 0.82 -1.64 0.00 0.00 178.16 177.92 3mfw h ILE 189 N 0.45 1.23 -0.38 1.81 2.04 -0.22 0.17 117.51 122.60 3mfw h ILE 189 Ca 0.21 -0.63 0.06 0.00 1.00 0.00 0.00 64.86 65.49 3mfw h ILE 189 Cb 0.13 0.31 -0.05 0.00 -0.74 0.00 0.00 36.82 36.47 3mfw h ILE 189 CO -0.15 0.27 0.09 -0.07 0.00 0.00 0.00 178.15 178.28 3mfw h LEU 190 N 1.01 0.04 -0.43 1.44 3.38 -0.51 0.68 115.31 120.93 3mfw h LEU 190 Ca 0.25 0.06 -0.18 0.00 0.09 0.00 0.00 57.88 58.10 3mfw h LEU 190 Cb 0.09 0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 3mfw h LEU 190 CO -0.03 0.06 -0.67 0.11 0.09 0.00 0.00 178.44 177.99 3mfw h LYS 191 N 0.22 0.48 -0.27 1.13 1.79 -1.07 -0.81 116.57 118.04 3mfw h LYS 191 Ca 0.18 -0.36 -0.12 0.00 -2.18 0.00 0.00 60.65 58.17 3mfw h LYS 191 Cb 0.21 0.06 -0.00 0.00 -1.58 0.00 0.00 32.23 30.92 3mfw h LYS 191 CO -0.23 0.98 -0.32 1.15 -1.08 0.00 0.00 179.45 179.95 3mfw h THR 192 N 0.34 1.31 -0.00 -0.16 2.02 -0.45 -3.19 112.91 112.78 3mfw h THR 192 Ca -0.02 -1.50 0.00 0.00 0.77 0.00 0.00 66.41 65.66 3mfw h THR 192 Cb 1.24 1.65 0.00 0.00 -1.74 0.00 0.00 68.15 69.30 3mfw h THR 192 CO 0.12 0.48 -0.21 0.18 0.37 0.00 0.00 175.52 176.46 3mfw n LEU 193 N -4.25 0.30 -1.50 2.58 4.77 0.21 -4.92 117.00 114.19 3mfw n LEU 193 Ca -0.04 0.19 -0.09 0.00 -0.03 0.00 0.00 56.01 56.04 3mfw n LEU 193 Cb 0.49 -0.33 0.02 0.00 -2.33 0.00 0.00 43.42 41.27 3mfw n LEU 193 CO 0.45 0.07 0.05 0.61 -1.33 0.00 0.00 177.39 177.24 3mfw n GLY 194 N 1.44 0.29 3.77 -0.72 0.00 -0.44 -4.85 105.19 104.69 3mfw n GLY 194 Ca 0.08 -0.37 -0.38 0.00 0.00 0.00 0.00 46.02 45.35 3mfw n GLY 194 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3mfw s ILE 195 N -2.94 3.28 -0.09 -0.61 1.01 -0.45 -4.85 121.20 116.54 3mfw s ILE 195 Ca 0.17 1.03 -0.23 0.00 0.00 0.00 0.00 60.65 61.62 3mfw s ILE 195 Cb -0.08 -3.56 -0.03 0.00 0.01 0.00 0.00 42.46 38.80 3mfw s ILE 195 CO 0.21 0.05 0.68 -0.75 0.00 0.00 0.00 174.94 175.14 3mfw s LYS 196 N -2.41 4.39 -0.01 2.79 2.47 -1.26 -4.89 119.74 120.82 3mfw s LYS 196 Ca 0.58 0.83 -0.12 0.00 -1.56 0.00 0.00 55.97 55.70 3mfw s LYS 196 Cb -0.28 -3.47 0.01 0.00 -1.46 0.00 0.00 37.83 32.63 3mfw s LYS 196 CO 0.35 0.01 0.24 1.52 0.16 0.00 0.00 175.35 177.63 3mfw s TYR 197 N 1.02 -0.09 -0.44 4.03 -0.85 -1.26 -2.53 117.35 117.22 3mfw s TYR 197 Ca 0.36 0.11 0.04 0.00 -0.52 0.00 0.00 57.07 57.06 3mfw s TYR 197 Cb -0.17 0.04 0.12 0.00 0.38 0.00 0.00 41.96 42.32 3mfw s TYR 197 CO 0.16 -0.34 0.17 -0.06 -1.52 0.00 0.00 175.55 173.96 3mfw s PHE 198 N -1.31 3.42 1.07 -3.49 0.40 0.39 -4.95 117.98 113.50 3mfw s PHE 198 Ca -0.14 -3.09 -0.14 0.00 -0.60 0.00 0.00 56.93 52.96 3mfw s PHE 198 Cb -0.06 -2.85 0.22 0.00 0.51 0.00 0.00 43.02 40.84 3mfw s PHE 198 CO 0.03 -0.83 1.08 -1.54 0.70 0.00 0.00 175.22 174.66 3mfw s SER 199 N 0.23 2.00 0.54 1.36 1.04 -1.26 -1.07 113.70 116.55 3mfw s SER 199 Ca 0.14 1.10 0.22 0.00 0.48 0.00 0.00 55.95 57.90 3mfw s SER 199 Cb -0.23 -1.71 1.43 0.00 0.10 0.00 0.00 66.02 65.60 3mfw s SER 199 CO -0.04 -3.51 2.11 0.24 0.98 0.00 0.00 173.24 173.03 3mfw h MET 200 N -2.15 0.00 -0.59 4.02 2.86 -1.14 -0.13 114.93 117.80 3mfw h MET 200 Ca -0.54 0.00 0.04 0.00 -2.06 0.00 0.00 59.70 57.14 3mfw h MET 200 Cb 1.33 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.94 3mfw h MET 200 CO 0.53 0.00 0.33 1.15 1.06 0.00 0.00 176.91 179.98 3mfw h THR 201 N 0.00 1.00 -0.35 2.22 2.02 -1.91 0.11 112.91 116.00 3mfw h THR 201 Ca 0.09 -0.22 -0.11 0.00 0.77 0.00 0.00 66.41 66.94 3mfw h THR 201 Cb 0.37 0.31 -0.01 0.00 -1.74 0.00 0.00 68.15 67.08 3mfw h THR 201 CO -0.00 0.12 -0.23 -0.33 0.37 0.00 0.00 175.52 175.45 3mfw h GLU 202 N 0.64 0.69 -0.50 6.66 3.07 -1.40 -0.00 114.58 123.73 3mfw h GLU 202 Ca 0.25 -0.27 -0.07 0.00 -0.50 0.00 0.00 59.36 58.77 3mfw h GLU 202 Cb 0.11 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 27.96 3mfw h GLU 202 CO -0.14 0.86 0.02 0.28 -1.40 0.00 0.00 179.01 178.62 3mfw h VAL 203 N 0.60 1.24 -0.48 3.13 2.07 -0.76 -0.24 116.25 121.82 3mfw h VAL 203 Ca 0.09 -1.00 -0.04 0.00 0.82 0.00 0.00 66.70 66.57 3mfw h VAL 203 Cb 0.71 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 31.30 3mfw h VAL 203 CO 0.05 0.36 0.14 0.44 0.02 0.00 0.00 177.57 178.58 3mfw h ASP 204 N 0.77 0.71 -0.01 0.57 3.32 -0.42 0.16 116.42 121.53 3mfw h ASP 204 Ca 0.15 -0.22 -0.00 0.00 0.02 0.00 0.00 57.03 56.99 3mfw h ASP 204 Cb 0.44 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 39.81 3mfw h ASP 204 CO 0.02 0.74 0.00 -0.09 -1.72 0.00 0.00 179.24 178.19 3mfw h ARG 205 N 0.64 0.01 0.00 3.56 2.43 -0.64 -3.36 114.38 117.02 3mfw h ARG 205 Ca 0.15 -0.00 -0.31 0.00 -0.81 0.00 0.00 59.98 59.01 3mfw h ARG 205 Cb 0.29 -0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.78 3mfw h ARG 205 CO -0.00 0.18 -2.18 1.28 -1.51 0.00 0.00 179.97 177.74 3mfw n LEU 206 N -5.00 0.21 0.00 3.80 4.77 -0.13 -5.10 117.00 115.54 3mfw n LEU 206 Ca -0.07 0.10 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 3mfw n LEU 206 Cb 0.11 0.38 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 3mfw n LEU 206 CO 0.33 0.42 0.00 0.61 -1.33 0.00 0.00 177.39 177.42 3mfw n GLY 207 N 1.65 -0.50 0.27 -0.72 0.00 0.04 -4.32 105.19 101.62 3mfw n GLY 207 Ca -0.26 -1.47 0.14 0.00 0.00 0.00 0.00 46.02 44.43 3mfw n GLY 207 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3mfw h ILE 208 N 0.00 0.51 0.44 -0.61 6.09 -1.93 -1.37 117.51 120.63 3mfw h ILE 208 Ca 0.00 -0.41 -0.02 0.00 -1.37 0.00 0.00 64.86 63.06 3mfw h ILE 208 Cb 0.00 1.27 0.00 0.00 0.47 0.00 0.00 36.82 38.57 3mfw h ILE 208 CO 0.00 0.09 -0.21 1.23 -3.07 0.00 0.00 178.15 176.19 3mfw h GLY 209 N 0.71 -0.61 1.28 8.18 0.00 -1.96 -1.32 103.07 109.34 3mfw h GLY 209 Ca -0.00 0.23 -0.08 0.00 0.00 0.00 0.00 47.33 47.48 3mfw h GLY 209 CO 0.01 -0.22 0.00 1.70 0.00 0.00 0.00 176.54 178.03 3mfw h LYS 210 N -0.65 0.88 -0.60 4.80 1.63 -1.66 -1.15 116.57 119.81 3mfw h LYS 210 Ca -0.06 -0.25 0.10 0.00 -0.85 0.00 0.00 60.65 59.59 3mfw h LYS 210 Cb 0.49 -0.10 -0.08 0.00 -0.60 0.00 0.00 32.23 31.94 3mfw h LYS 210 CO 0.10 0.87 0.18 0.28 -3.45 0.00 0.00 179.45 177.44 3mfw h VAL 211 N 0.81 0.72 -0.20 2.00 2.07 -1.09 0.39 116.25 120.95 3mfw h VAL 211 Ca 0.15 -0.12 -0.18 0.00 0.82 0.00 0.00 66.70 67.38 3mfw h VAL 211 Cb 0.48 0.34 -0.00 0.00 -1.52 0.00 0.00 31.29 30.60 3mfw h VAL 211 CO 0.02 0.06 -0.59 0.24 0.02 0.00 0.00 177.57 177.33 3mfw h MET 212 N 0.34 0.67 -0.29 1.57 2.86 -0.86 0.19 114.93 119.41 3mfw h MET 212 Ca 0.31 -0.44 0.05 0.00 -2.06 0.00 0.00 59.70 57.55 3mfw h MET 212 Cb 0.42 0.06 -0.04 0.00 0.06 0.00 0.00 31.60 32.10 3mfw h MET 212 CO -0.35 1.06 0.02 1.49 1.06 0.00 0.00 176.91 180.19 3mfw h GLU 213 N 0.50 0.10 -0.14 1.72 4.81 -0.81 0.03 114.58 120.79 3mfw h GLU 213 Ca 0.00 -0.01 -0.13 0.00 -0.13 0.00 0.00 59.36 59.09 3mfw h GLU 213 Cb 1.17 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.51 3mfw h GLU 213 CO 0.12 0.07 -0.49 0.93 -0.73 0.00 0.00 179.01 178.91 3mfw h GLU 214 N 0.11 0.37 -0.32 1.92 5.08 -0.74 -0.72 114.58 120.27 3mfw h GLU 214 Ca 0.14 -0.21 -0.02 0.00 -1.00 0.00 0.00 59.36 58.27 3mfw h GLU 214 Cb 0.17 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 3mfw h GLU 214 CO -0.22 0.78 0.14 1.15 -1.00 0.00 0.00 179.01 179.86 3mfw h THR 215 N 0.29 1.17 -0.17 1.13 2.02 -0.15 -0.84 112.91 116.37 3mfw h THR 215 Ca 0.01 -0.52 -0.19 0.00 0.77 0.00 0.00 66.41 66.48 3mfw h THR 215 Cb 0.97 0.93 0.00 0.00 -1.74 0.00 0.00 68.15 68.31 3mfw h THR 215 CO 0.08 0.18 -0.66 -0.07 0.37 0.00 0.00 175.52 175.43 3mfw h LEU 216 N 0.37 0.74 -0.61 2.58 3.38 -0.91 -1.84 115.31 119.01 3mfw h LEU 216 Ca 0.11 -0.44 -0.11 0.00 0.09 0.00 0.00 57.88 57.52 3mfw h LEU 216 Cb 0.16 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 3mfw h LEU 216 CO -0.01 1.20 -0.12 -1.28 0.09 0.00 0.00 178.44 178.32 3mfw h SER 217 N 0.46 0.97 -0.93 -0.43 0.87 -1.04 0.39 113.55 113.85 3mfw h SER 217 Ca -0.02 -0.32 0.03 0.00 -1.23 0.00 0.00 61.79 60.25 3mfw h SER 217 Cb 1.25 -0.26 -0.05 0.00 -0.44 0.00 0.00 62.40 62.89 3mfw h SER 217 CO 0.13 1.09 0.61 0.22 -0.53 0.00 0.00 176.83 178.35 3mfw h TYR 218 N 0.86 1.15 0.00 2.24 3.20 -1.04 0.18 116.97 123.57 3mfw h TYR 218 Ca 0.13 0.03 -0.27 0.00 3.14 0.00 0.00 58.73 61.76 3mfw h TYR 218 Cb 0.67 -0.39 -0.04 0.00 1.54 0.00 0.00 36.73 38.51 3mfw h TYR 218 CO 0.04 0.69 -1.55 -0.07 -1.64 0.00 0.00 178.16 175.63 3mfw h LEU 219 N 1.21 0.01 -0.57 2.82 3.38 -0.97 -3.40 115.31 117.79 3mfw h LEU 219 Ca 0.36 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.31 3mfw h LEU 219 Cb -0.05 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.69 3mfw h LEU 219 CO -0.10 1.02 -0.21 0.18 0.09 0.00 0.00 178.44 179.42 3mfw n LEU 220 N -3.12 0.95 -0.06 1.67 4.77 0.13 -4.76 117.00 116.59 3mfw n LEU 220 Ca -0.13 -0.71 -0.07 0.00 -0.03 0.00 0.00 56.01 55.06 3mfw n LEU 220 Cb 1.03 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 42.11 3mfw n LEU 220 CO 0.45 0.20 0.76 1.23 -1.33 0.00 0.00 177.39 178.70 3mfw h GLY 221 N 1.79 0.05 1.53 -0.72 0.00 -0.75 -2.40 103.07 102.56 3mfw h GLY 221 Ca 0.00 0.18 -0.18 0.00 0.00 0.00 0.00 47.33 47.34 3mfw h GLY 221 CO 0.00 -0.16 -0.67 -0.09 0.00 0.00 0.00 176.54 175.63 3mfw h ARG 222 N -0.12 0.47 -1.36 4.80 2.43 -1.86 -3.47 114.38 115.27 3mfw h ARG 222 Ca 0.14 -0.35 0.16 0.00 -0.81 0.00 0.00 59.98 59.12 3mfw h ARG 222 Cb 0.33 0.06 -0.24 0.00 -0.42 0.00 0.00 29.97 29.70 3mfw h ARG 222 CO -0.33 0.98 0.74 -1.59 -1.51 0.00 0.00 179.97 178.25 3mfw s LYS 223 N -3.76 0.35 0.55 0.20 0.00 -0.90 -5.14 119.74 111.04 3mfw s LYS 223 Ca -0.06 0.06 -0.19 0.00 0.00 0.00 0.00 55.97 55.77 3mfw s LYS 223 Cb 0.11 0.17 -0.06 0.00 0.00 0.00 0.00 37.83 38.05 3mfw s LYS 223 CO 0.84 -0.12 1.14 0.15 0.00 0.00 0.00 175.35 177.37 3mfw s LYS 224 N -1.21 3.30 0.18 1.78 -0.14 -1.25 -4.55 119.74 117.84 3mfw s LYS 224 Ca 0.04 1.65 -0.22 0.00 -1.36 0.00 0.00 55.97 56.08 3mfw s LYS 224 Cb -0.01 -2.00 0.06 0.00 -1.68 0.00 0.00 37.83 34.20 3mfw s LYS 224 CO -0.03 -0.90 0.60 -0.98 -0.76 0.00 0.00 175.35 173.28 3mfw s ARG 225 N -3.28 1.36 0.41 1.68 1.04 -1.26 -5.10 118.95 113.80 3mfw s ARG 225 Ca 0.73 -0.59 -0.26 0.00 -1.04 0.00 0.00 55.73 54.57 3mfw s ARG 225 Cb -0.25 0.58 -0.09 0.00 -2.04 0.00 0.00 34.95 33.15 3mfw s ARG 225 CO 0.28 -0.60 1.39 -2.14 -0.04 0.00 0.00 175.30 174.20 3mfw s PRO 226 N -3.79 3.91 -0.14 3.89 0.02 -1.26 -4.79 135.00 132.84 3mfw s PRO 226 Ca 0.03 2.35 -0.05 0.00 0.02 0.00 0.00 61.00 63.35 3mfw s PRO 226 Cb -0.02 -2.78 -0.04 0.00 0.02 0.00 0.00 34.50 31.69 3mfw s PRO 226 CO -0.09 -0.61 0.05 0.42 -0.33 0.00 0.00 177.00 176.44 3mfw s ILE 227 N -1.20 4.73 -0.26 2.83 -1.09 -0.08 -0.71 121.20 125.42 3mfw s ILE 227 Ca 0.57 -0.07 -0.06 0.00 -2.23 0.00 0.00 60.65 58.86 3mfw s ILE 227 Cb -0.42 -3.07 -0.01 0.00 -1.58 0.00 0.00 42.46 37.38 3mfw s ILE 227 CO 0.55 0.53 0.04 -2.28 -1.23 0.00 0.00 174.94 172.56 3mfw s HIS 228 N -0.26 3.08 -0.35 3.97 5.65 0.60 -0.13 115.29 127.85 3mfw s HIS 228 Ca 0.08 -0.80 -0.13 0.00 0.25 0.00 0.00 55.06 54.46 3mfw s HIS 228 Cb -0.12 -2.21 -0.01 0.00 -1.18 0.00 0.00 32.58 29.06 3mfw s HIS 228 CO 0.02 -0.50 0.24 -1.17 -0.65 0.00 0.00 174.74 172.68 3mfw s LEU 229 N 1.53 4.57 -0.43 8.88 2.96 0.26 -0.89 118.68 135.56 3mfw s LEU 229 Ca 0.05 -0.47 -0.09 0.00 -0.22 0.00 0.00 54.13 53.39 3mfw s LEU 229 Cb -0.16 -2.14 0.08 0.00 0.50 0.00 0.00 46.19 44.48 3mfw s LEU 229 CO 0.01 -0.25 0.28 -0.55 -1.32 0.00 0.00 176.35 174.52 3mfw s SER 230 N 1.72 5.67 -0.32 3.68 0.15 0.49 -0.90 113.70 124.19 3mfw s SER 230 Ca 0.06 -1.55 -0.08 0.00 0.70 0.00 0.00 55.95 55.08 3mfw s SER 230 Cb -0.18 -2.00 0.02 0.00 -1.71 0.00 0.00 66.02 62.15 3mfw s SER 230 CO 0.10 -0.56 0.11 0.12 1.20 0.00 0.00 173.24 174.21 3mfw s PHE 231 N 1.43 3.19 -0.24 3.44 2.19 0.12 -1.18 117.98 126.93 3mfw s PHE 231 Ca 0.03 -1.00 -0.17 0.00 0.33 0.00 0.00 56.93 56.13 3mfw s PHE 231 Cb -0.23 -2.30 -0.03 0.00 -1.31 0.00 0.00 43.02 39.14 3mfw s PHE 231 CO 0.02 -0.60 0.44 0.34 1.83 0.00 0.00 175.22 177.25 3mfw s ASP 232 N 1.51 6.39 0.57 6.13 -1.08 -0.11 -0.65 116.67 129.43 3mfw s ASP 232 Ca 0.02 0.47 0.38 0.00 -0.52 0.00 0.00 52.55 52.90 3mfw s ASP 232 Cb -0.18 -2.25 2.04 0.00 -1.46 0.00 0.00 42.92 41.07 3mfw s ASP 232 CO 0.04 -0.19 2.17 -0.37 0.52 0.00 0.00 175.17 177.34 3mfw h VAL 233 N 5.27 0.00 0.00 1.11 -1.51 -1.59 0.47 116.25 120.00 3mfw h VAL 233 Ca -0.32 -0.06 0.00 0.00 -1.23 0.00 0.00 66.70 65.09 3mfw h VAL 233 Cb 1.15 0.94 0.00 0.00 -2.13 0.00 0.00 31.29 31.26 3mfw h VAL 233 CO 0.70 0.00 0.00 -0.90 -1.23 0.00 0.00 177.57 176.14 3mfw n ASP 234 N -2.89 0.00 0.11 4.19 3.85 -1.26 -1.96 116.55 118.59 3mfw n ASP 234 Ca -0.02 -0.35 -0.02 0.00 -0.71 0.00 0.00 54.79 53.69 3mfw n ASP 234 Cb 0.09 -0.13 0.22 0.00 -1.35 0.00 0.00 41.12 39.94 3mfw n ASP 234 CO 0.00 0.00 0.00 1.23 -1.01 0.00 0.00 177.20 177.42 3mfw h GLY 235 N 3.28 0.20 -1.72 6.12 0.00 -1.14 -3.32 103.07 106.49 3mfw h GLY 235 Ca 0.00 -0.20 -0.48 0.00 0.00 0.00 0.00 47.33 46.65 3mfw h GLY 235 CO 0.00 0.18 0.38 1.08 0.00 0.00 0.00 176.54 178.18 3mfw s LEU 236 N -8.12 3.56 0.52 3.11 1.43 -0.83 -2.34 118.68 116.02 3mfw s LEU 236 Ca -0.04 1.63 -0.23 0.00 -1.03 0.00 0.00 54.13 54.46 3mfw s LEU 236 Cb 0.13 -4.51 -0.06 0.00 0.03 0.00 0.00 46.19 41.78 3mfw s LEU 236 CO 0.77 -0.77 1.33 -0.67 0.23 0.00 0.00 176.35 177.24 3mfw n ASP 237 N -1.78 2.61 0.11 2.29 -0.08 0.49 -4.65 116.55 115.53 3mfw n ASP 237 Ca 0.07 1.00 0.07 0.00 -1.51 0.00 0.00 54.79 54.43 3mfw n ASP 237 Cb 0.54 -1.56 0.39 0.00 2.34 0.00 0.00 41.12 42.83 3mfw n ASP 237 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 3mfw n PRO 238 N -0.74 0.09 0.14 -0.67 -0.02 -1.26 -0.90 135.00 131.64 3mfw n PRO 238 Ca 0.09 0.59 0.13 0.00 -2.02 0.00 0.00 63.50 62.29 3mfw n PRO 238 Cb 0.44 -1.80 0.47 0.00 -0.02 0.00 0.00 33.50 32.58 3mfw n PRO 238 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3mfw h SER 239 N 0.00 0.00 0.00 2.55 4.64 -1.96 -2.84 113.55 115.94 3mfw h SER 239 Ca 0.00 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.07 3mfw h SER 239 Cb 0.01 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.05 3mfw h SER 239 CO 0.00 0.00 -1.95 0.49 -0.87 0.00 0.00 176.83 174.50 3mfw n PHE 240 N -2.39 0.00 -3.07 4.77 3.72 -0.08 -4.83 117.46 115.58 3mfw n PHE 240 Ca 0.03 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.20 3mfw n PHE 240 Cb 0.32 -0.66 -0.04 0.00 -0.94 0.00 0.00 39.48 38.17 3mfw n PHE 240 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 3mfw n THR 241 N -2.82 1.75 0.21 4.37 -2.24 -0.73 -3.89 114.28 110.93 3mfw n THR 241 Ca -0.27 -5.15 0.06 0.00 -2.27 0.00 0.00 64.05 56.42 3mfw n THR 241 Cb 0.86 -1.05 0.46 0.00 -2.10 0.00 0.00 70.33 68.50 3mfw n THR 241 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 3mfw h PRO 242 N 3.09 0.00 -5.23 -0.78 0.13 -1.76 -3.37 132.00 124.08 3mfw h PRO 242 Ca 0.12 0.00 -0.71 0.00 -0.87 0.00 0.00 66.00 64.55 3mfw h PRO 242 Cb 0.69 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 31.71 3mfw h PRO 242 CO 0.69 0.29 2.00 0.00 -0.23 0.00 0.00 178.00 180.76 3mfw n ALA 243 N -2.37 3.91 -3.16 -0.56 0.00 -1.26 -4.76 120.51 112.31 3mfw n ALA 243 Ca -0.01 -4.01 -0.13 0.00 0.00 0.00 0.00 53.44 49.30 3mfw n ALA 243 Cb 0.38 -3.39 -0.06 0.00 0.00 0.00 0.00 19.45 16.38 3mfw n ALA 243 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3mfw s THR 244 N 3.08 0.05 0.26 0.00 -1.32 -1.26 -0.56 115.64 115.90 3mfw s THR 244 Ca 0.49 -0.44 -0.01 0.00 -1.21 0.00 0.00 61.69 60.52 3mfw s THR 244 Cb 0.03 -0.99 0.07 0.00 -1.51 0.00 0.00 72.50 70.10 3mfw s THR 244 CO 0.04 -0.24 1.70 1.23 -2.21 0.00 0.00 174.62 175.14 3mfw h GLY 245 N 2.86 0.69 -6.03 6.08 0.00 -1.88 -3.37 103.07 101.42 3mfw h GLY 245 Ca -0.32 -0.55 -0.56 0.00 0.00 0.00 0.00 47.33 45.90 3mfw h GLY 245 CO 0.44 0.50 -0.98 -1.30 0.00 0.00 0.00 176.54 175.20 3mfw n THR 246 N -4.14 0.17 -2.20 4.70 -2.24 -1.26 -5.10 114.28 104.21 3mfw n THR 246 Ca 0.00 -4.39 -0.38 0.00 -2.27 0.00 0.00 64.05 57.02 3mfw n THR 246 Cb 0.39 -1.85 -0.01 0.00 -2.10 0.00 0.00 70.33 66.76 3mfw n THR 246 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3mfw s PRO 247 N -1.65 3.85 -0.05 -0.78 0.04 -1.26 -4.97 135.00 130.19 3mfw s PRO 247 Ca 0.37 1.90 0.01 0.00 0.04 0.00 0.00 61.00 63.32 3mfw s PRO 247 Cb 0.18 -2.55 0.02 0.00 0.04 0.00 0.00 34.50 32.19 3mfw s PRO 247 CO -0.08 -0.51 -0.05 0.08 0.04 0.00 0.00 177.00 176.48 3mfw s VAL 248 N -1.43 0.57 0.88 -0.36 1.01 -1.26 -5.05 120.40 114.76 3mfw s VAL 248 Ca 0.61 -0.13 -0.11 0.00 0.00 0.00 0.00 61.98 62.35 3mfw s VAL 248 Cb -0.32 -0.60 0.12 0.00 0.00 0.00 0.00 36.38 35.59 3mfw s VAL 248 CO 0.39 0.24 1.09 0.68 0.00 0.00 0.00 175.10 177.51 3mfw s VAL 249 N 1.00 2.72 0.00 2.92 -7.23 -1.26 -3.99 120.40 114.55 3mfw s VAL 249 Ca -0.10 0.23 0.00 0.00 -1.81 0.00 0.00 61.98 60.31 3mfw s VAL 249 Cb -0.14 -2.64 0.00 0.00 0.56 0.00 0.00 36.38 34.16 3mfw s VAL 249 CO -0.00 -0.30 0.00 0.61 -0.31 0.00 0.00 175.10 175.09 3mfw n GLY 250 N -0.87 0.60 1.27 2.32 0.00 -1.26 -5.01 105.19 102.24 3mfw n GLY 250 Ca 0.08 -0.79 -0.08 0.00 0.00 0.00 0.00 46.02 45.23 3mfw n GLY 250 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mfw n GLY 251 N -0.85 0.11 3.77 -0.02 0.00 -1.26 -4.95 105.19 101.99 3mfw n GLY 251 Ca 0.00 -1.89 -0.39 0.00 0.00 0.00 0.00 46.02 43.75 3mfw n GLY 251 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3mfw s LEU 252 N 0.00 4.13 0.78 0.99 1.43 -0.99 -4.33 118.68 120.69 3mfw s LEU 252 Ca 0.23 2.52 -0.10 0.00 -1.03 0.00 0.00 54.13 55.74 3mfw s LEU 252 Cb -0.01 -4.03 0.08 0.00 0.03 0.00 0.00 46.19 42.26 3mfw s LEU 252 CO 0.15 -0.89 1.13 0.42 0.23 0.00 0.00 176.35 177.39 3mfw s THR 253 N -1.36 2.10 0.15 5.49 -4.23 -1.26 -0.38 115.64 116.16 3mfw s THR 253 Ca 0.60 -0.11 -0.16 0.00 -1.18 0.00 0.00 61.69 60.83 3mfw s THR 253 Cb -0.35 -2.99 0.01 0.00 1.34 0.00 0.00 72.50 70.52 3mfw s THR 253 CO 0.43 0.00 1.78 0.22 -0.54 0.00 0.00 174.62 176.51 3mfw h TYR 254 N -0.92 0.35 -0.37 3.99 3.20 -1.95 -0.16 116.97 121.10 3mfw h TYR 254 Ca -0.45 0.01 0.07 0.00 3.14 0.00 0.00 58.73 61.50 3mfw h TYR 254 Cb 1.32 -0.11 -0.06 0.00 1.54 0.00 0.00 36.73 39.42 3mfw h TYR 254 CO 0.19 0.19 -0.02 0.00 -1.64 0.00 0.00 178.16 176.88 3mfw h ARG 255 N 0.39 0.08 -0.93 1.82 3.08 -1.99 -1.19 114.38 115.64 3mfw h ARG 255 Ca 0.15 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.19 3mfw h ARG 255 Cb 0.05 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.04 3mfw h ARG 255 CO -0.10 0.05 0.53 0.93 -1.07 0.00 0.00 179.97 180.32 3mfw h GLU 256 N 0.08 1.28 -0.39 0.04 5.08 -1.79 0.17 114.58 119.05 3mfw h GLU 256 Ca 0.18 -0.13 -0.11 0.00 -1.00 0.00 0.00 59.36 58.30 3mfw h GLU 256 Cb 0.26 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 3mfw h GLU 256 CO -0.32 0.91 -0.20 0.78 -1.00 0.00 0.00 179.01 179.18 3mfw h GLY 257 N 1.29 0.81 1.69 -3.84 0.00 -0.43 -0.56 103.07 102.04 3mfw h GLY 257 Ca 0.33 -0.68 -0.11 0.00 0.00 0.00 0.00 47.33 46.88 3mfw h GLY 257 CO -0.06 0.62 -0.36 1.41 0.00 0.00 0.00 176.54 178.15 3mfw h LEU 258 N 0.66 0.36 -0.01 3.11 3.38 -0.81 -2.70 115.31 119.31 3mfw h LEU 258 Ca 0.10 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 3mfw h LEU 258 Cb 0.70 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 3mfw h LEU 258 CO 0.05 0.69 0.00 0.22 0.09 0.00 0.00 178.44 179.50 3mfw h TYR 259 N 0.30 0.02 -0.49 1.13 3.20 0.04 0.71 116.97 121.87 3mfw h TYR 259 Ca 0.03 -0.00 0.10 0.00 3.14 0.00 0.00 58.73 62.00 3mfw h TYR 259 Cb 0.77 -0.00 -0.09 0.00 1.54 0.00 0.00 36.73 38.95 3mfw h TYR 259 CO 0.02 0.25 -0.04 0.82 -1.64 0.00 0.00 178.16 177.58 3mfw h ILE 260 N -0.22 0.58 0.01 1.81 2.04 -1.07 -1.06 117.51 119.59 3mfw h ILE 260 Ca 0.00 -0.03 -0.20 0.00 1.00 0.00 0.00 64.86 65.64 3mfw h ILE 260 Cb 0.24 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 3mfw h ILE 260 CO 0.00 0.01 -0.88 0.71 0.00 0.00 0.00 178.15 177.99 3mfw h THR 261 N 0.08 1.51 -0.60 -0.27 1.35 -1.35 -1.34 112.91 112.29 3mfw h THR 261 Ca 0.25 -2.68 -0.08 0.00 -0.55 0.00 0.00 66.41 63.35 3mfw h THR 261 Cb 0.38 2.50 -0.02 0.00 -1.73 0.00 0.00 68.15 69.27 3mfw h THR 261 CO -0.44 0.78 0.06 -0.33 -0.25 0.00 0.00 175.52 175.34 3mfw h GLU 262 N 0.09 1.02 -0.26 4.72 5.08 -0.59 0.33 114.58 124.97 3mfw h GLU 262 Ca -0.04 -0.29 -0.15 0.00 -1.00 0.00 0.00 59.36 57.88 3mfw h GLU 262 Cb 1.52 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.65 3mfw h GLU 262 CO 0.13 0.98 -0.44 0.93 -1.00 0.00 0.00 179.01 179.61 3mfw h GLU 263 N 0.92 0.65 -0.55 2.33 4.39 -1.02 -1.73 114.58 119.56 3mfw h GLU 263 Ca 0.18 -0.35 -0.11 0.00 0.34 0.00 0.00 59.36 59.41 3mfw h GLU 263 Cb 0.48 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.13 3mfw h GLU 263 CO 0.02 0.96 -0.08 0.82 -1.16 0.00 0.00 179.01 179.57 3mfw h ILE 264 N 0.52 1.27 -0.49 3.13 2.04 -0.93 -2.76 117.51 120.29 3mfw h ILE 264 Ca 0.04 -1.24 0.05 0.00 1.00 0.00 0.00 64.86 64.71 3mfw h ILE 264 Cb 0.98 0.92 -0.05 0.00 -0.74 0.00 0.00 36.82 37.94 3mfw h ILE 264 CO 0.09 0.44 0.23 0.22 0.00 0.00 0.00 178.15 179.13 3mfw h TYR 265 N 0.92 0.42 0.00 1.37 3.20 -0.70 -1.98 116.97 120.20 3mfw h TYR 265 Ca 0.15 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.04 3mfw h TYR 265 Cb 0.65 -0.12 -0.00 0.00 1.54 0.00 0.00 36.73 38.80 3mfw h TYR 265 CO 0.04 0.19 -0.01 0.87 -1.64 0.00 0.00 178.16 177.61 3mfw h LYS 266 N 0.45 0.00 0.00 1.82 1.57 -1.04 -1.68 116.57 117.69 3mfw h LYS 266 Ca 0.22 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.98 3mfw h LYS 266 Cb 0.16 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.46 3mfw h LYS 266 CO -0.17 0.01 -0.08 1.79 -0.57 0.00 0.00 179.45 180.43 3mfw h THR 267 N 0.00 0.31 -0.04 -0.16 1.35 -1.16 -3.46 112.91 109.76 3mfw h THR 267 Ca -0.00 -0.50 -0.02 0.00 -0.55 0.00 0.00 66.41 65.34 3mfw h THR 267 Cb 0.12 1.38 -0.01 0.00 -1.73 0.00 0.00 68.15 67.91 3mfw h THR 267 CO 0.00 0.08 -0.01 0.61 -0.25 0.00 0.00 175.52 175.95 3mfw n GLY 268 N -0.46 0.27 0.48 5.82 0.00 -0.63 -4.88 105.19 105.79 3mfw n GLY 268 Ca -0.01 -0.03 0.06 0.00 0.00 0.00 0.00 46.02 46.04 3mfw n GLY 268 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3mfw n LEU 269 N -0.09 2.11 -4.70 0.99 4.77 -1.26 -5.00 117.00 113.82 3mfw n LEU 269 Ca -0.01 -1.17 -0.43 0.00 -0.03 0.00 0.00 56.01 54.37 3mfw n LEU 269 Cb 0.31 -0.04 -0.03 0.00 -2.33 0.00 0.00 43.42 41.32 3mfw n LEU 269 CO 0.01 0.43 1.35 -0.11 -1.33 0.00 0.00 177.39 177.74 3mfw n LEU 270 N 0.62 3.79 0.00 2.23 7.94 -1.26 -0.90 117.00 129.42 3mfw n LEU 270 Ca 0.07 1.06 0.00 0.00 -1.11 0.00 0.00 56.01 56.03 3mfw n LEU 270 Cb 0.31 -1.53 0.00 0.00 0.53 0.00 0.00 43.42 42.72 3mfw n LEU 270 CO 0.07 0.07 -0.35 -0.24 -1.11 0.00 0.00 177.39 175.83 3mfw n SER 271 N 4.08 3.52 -3.57 1.96 2.88 0.81 -4.81 113.62 118.48 3mfw n SER 271 Ca 0.17 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.55 3mfw n SER 271 Cb 0.34 0.49 -0.06 0.00 -0.75 0.00 0.00 64.21 64.23 3mfw n SER 271 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 3mfw s GLY 272 N -2.00 -0.47 -0.03 0.46 0.00 -0.96 -2.76 107.32 101.56 3mfw s GLY 272 Ca 0.00 0.93 -0.03 0.00 0.00 0.00 0.00 44.72 45.62 3mfw s GLY 272 CO 0.00 0.61 0.09 -2.27 0.00 0.00 0.00 173.10 171.54 3mfw s LEU 273 N -1.48 1.65 -0.06 0.66 2.96 0.24 -0.57 118.68 122.07 3mfw s LEU 273 Ca -0.09 0.18 0.05 0.00 -0.22 0.00 0.00 54.13 54.05 3mfw s LEU 273 Cb -0.01 0.32 -0.00 0.00 0.50 0.00 0.00 46.19 47.00 3mfw s LEU 273 CO 0.05 -0.04 -0.21 -1.81 -1.32 0.00 0.00 176.35 173.02 3mfw s ASP 274 N 0.03 2.69 -0.32 3.68 1.01 -0.08 -0.46 116.67 123.22 3mfw s ASP 274 Ca -0.00 -0.45 0.03 0.00 0.71 0.00 0.00 52.55 52.84 3mfw s ASP 274 Cb -0.01 -0.87 0.09 0.00 1.01 0.00 0.00 42.92 43.14 3mfw s ASP 274 CO 0.00 0.18 0.03 -0.63 0.21 0.00 0.00 175.17 174.96 3mfw s ILE 275 N 0.06 2.12 0.26 0.77 -1.09 -0.14 -0.70 121.20 122.47 3mfw s ILE 275 Ca -0.07 -2.12 0.11 0.00 -2.23 0.00 0.00 60.65 56.33 3mfw s ILE 275 Cb -0.14 -2.51 -0.05 0.00 -1.58 0.00 0.00 42.46 38.18 3mfw s ILE 275 CO 0.04 -0.50 -0.19 -0.04 -1.23 0.00 0.00 174.94 173.02 3mfw s MET 276 N 1.01 1.58 -0.08 2.79 -1.94 0.17 -0.83 119.30 122.00 3mfw s MET 276 Ca 0.07 -1.71 0.00 0.00 -1.71 0.00 0.00 55.69 52.34 3mfw s MET 276 Cb -0.19 -1.60 0.00 0.00 2.01 0.00 0.00 34.83 35.05 3mfw s MET 276 CO -0.09 0.29 0.00 0.39 -0.01 0.00 0.00 175.02 175.60 3mfw n GLU 277 N -0.52 -0.08 -2.25 2.03 -0.58 -0.21 -1.61 120.64 117.42 3mfw n GLU 277 Ca -0.06 0.39 -0.43 0.00 -0.42 0.00 0.00 57.16 56.65 3mfw n GLU 277 Cb 0.60 -3.81 -0.02 0.00 -0.57 0.00 0.00 31.44 27.64 3mfw n GLU 277 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 3mfw s VAL 278 N -2.01 3.96 -0.35 2.62 1.01 -1.26 -4.34 120.40 120.02 3mfw s VAL 278 Ca 0.00 1.19 0.01 0.00 0.00 0.00 0.00 61.98 63.18 3mfw s VAL 278 Cb 0.00 -3.77 0.11 0.00 0.00 0.00 0.00 36.38 32.72 3mfw s VAL 278 CO 0.00 -0.09 0.13 0.21 0.00 0.00 0.00 175.10 175.35 3mfw s ASN 279 N 2.44 4.04 0.40 3.32 3.84 0.28 -4.09 114.94 125.17 3mfw s ASN 279 Ca 0.63 -1.99 0.11 0.00 0.21 0.00 0.00 52.86 51.82 3mfw s ASN 279 Cb -0.27 -1.03 0.83 0.00 -0.55 0.00 0.00 41.25 40.23 3mfw s ASN 279 CO 0.22 -0.37 1.92 -0.65 -2.79 0.00 0.00 177.10 175.43 3mfw h PRO 280 N 7.65 0.17 0.00 0.43 0.11 -1.79 -1.27 132.00 137.29 3mfw h PRO 280 Ca -0.09 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.98 3mfw h PRO 280 Cb 0.99 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.08 3mfw h PRO 280 CO 0.48 0.33 0.05 0.77 -0.21 0.00 0.00 178.00 179.42 3mfw h SER 281 N 0.16 0.00 -0.25 -2.05 0.02 -1.87 -2.40 113.55 107.17 3mfw h SER 281 Ca 0.03 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 3mfw h SER 281 Cb 0.39 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.93 3mfw h SER 281 CO 0.02 0.00 0.00 0.18 -1.14 0.00 0.00 176.83 175.89 3mfw n LEU 282 N -2.70 3.28 -4.75 5.07 4.77 -0.48 -4.89 117.00 117.30 3mfw n LEU 282 Ca -0.02 -1.31 -0.41 0.00 -0.03 0.00 0.00 56.01 54.24 3mfw n LEU 282 Cb 0.10 -0.15 -0.04 0.00 -2.33 0.00 0.00 43.42 40.99 3mfw n LEU 282 CO 0.15 0.65 0.80 -0.83 -1.33 0.00 0.00 177.39 176.83 3mfw s GLY 283 N -1.67 2.97 0.38 -0.72 0.00 -0.90 -4.62 107.32 102.75 3mfw s GLY 283 Ca 0.34 0.87 0.28 0.00 0.00 0.00 0.00 44.72 46.21 3mfw s GLY 283 CO 0.31 1.57 1.83 0.50 0.00 0.00 0.00 173.10 177.30 3mfw h LYS 284 N 4.34 0.00 -3.44 2.90 1.57 -1.91 -3.45 116.57 116.57 3mfw h LYS 284 Ca -0.46 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.27 3mfw h LYS 284 Cb 1.21 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 33.39 3mfw h LYS 284 CO 0.69 0.00 -0.11 0.95 -0.57 0.00 0.00 179.45 180.41 3mfw s THR 285 N -3.46 0.08 0.36 -0.16 -4.23 -1.26 -5.03 115.64 101.94 3mfw s THR 285 Ca 0.03 -0.65 0.08 0.00 -1.18 0.00 0.00 61.69 59.96 3mfw s THR 285 Cb 0.09 -1.18 0.31 0.00 1.34 0.00 0.00 72.50 73.06 3mfw s THR 285 CO 0.45 -0.36 1.90 -0.65 -0.54 0.00 0.00 174.62 175.42 3mfw h PRO 286 N 2.43 0.70 -0.20 3.99 0.11 -1.98 -1.10 132.00 135.93 3mfw h PRO 286 Ca -0.34 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 65.62 3mfw h PRO 286 Cb 1.25 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 3mfw h PRO 286 CO 0.48 0.46 -0.34 1.49 -0.21 0.00 0.00 178.00 179.89 3mfw h GLU 287 N 0.72 0.43 -0.30 1.05 4.22 -1.97 -1.91 114.58 116.81 3mfw h GLU 287 Ca 0.40 -0.19 -0.03 0.00 0.08 0.00 0.00 59.36 59.62 3mfw h GLU 287 Cb 0.54 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.77 3mfw h GLU 287 CO -0.16 0.71 0.04 0.93 -2.18 0.00 0.00 179.01 178.35 3mfw h GLU 288 N 0.37 0.45 0.11 1.92 5.08 -1.57 -0.79 114.58 120.14 3mfw h GLU 288 Ca 0.04 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 3mfw h GLU 288 Cb 0.77 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.94 3mfw h GLU 288 CO 0.06 0.44 -0.05 0.28 -1.00 0.00 0.00 179.01 178.74 3mfw h VAL 289 N 0.44 1.07 -0.31 3.13 2.07 -1.22 -1.81 116.25 119.62 3mfw h VAL 289 Ca 0.10 -0.79 -0.04 0.00 0.82 0.00 0.00 66.70 66.79 3mfw h VAL 289 Cb 0.23 1.56 -0.02 0.00 -1.52 0.00 0.00 31.29 31.54 3mfw h VAL 289 CO 0.00 0.19 0.04 0.71 0.02 0.00 0.00 177.57 178.53 3mfw h THR 290 N -0.53 1.17 -0.50 2.57 1.35 -1.31 -0.32 112.91 115.35 3mfw h THR 290 Ca -0.02 -0.63 -0.01 0.00 -0.55 0.00 0.00 66.41 65.20 3mfw h THR 290 Cb 0.43 0.89 -0.02 0.00 -1.73 0.00 0.00 68.15 67.72 3mfw h THR 290 CO 0.03 0.22 0.27 -0.09 -0.25 0.00 0.00 175.52 175.69 3mfw h ARG 291 N 0.45 0.70 -0.05 4.72 2.43 -1.08 0.28 114.38 121.83 3mfw h ARG 291 Ca 0.10 -0.09 -0.01 0.00 -0.81 0.00 0.00 59.98 59.17 3mfw h ARG 291 Cb 0.24 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 29.66 3mfw h ARG 291 CO 0.00 0.55 -0.03 1.15 -1.51 0.00 0.00 179.97 180.14 3mfw h THR 292 N 0.66 1.33 -0.38 0.20 2.02 -0.45 -1.24 112.91 115.05 3mfw h THR 292 Ca 0.17 -1.03 -0.00 0.00 0.77 0.00 0.00 66.41 66.32 3mfw h THR 292 Cb 0.06 1.92 -0.02 0.00 -1.74 0.00 0.00 68.15 68.38 3mfw h THR 292 CO -0.03 0.28 0.23 0.58 0.37 0.00 0.00 175.52 176.95 3mfw h VAL 293 N -0.29 1.12 -0.75 3.16 2.07 -1.03 -1.14 116.25 119.39 3mfw h VAL 293 Ca 0.01 -0.29 0.02 0.00 0.82 0.00 0.00 66.70 67.27 3mfw h VAL 293 Cb 0.46 0.64 -0.04 0.00 -1.52 0.00 0.00 31.29 30.83 3mfw h VAL 293 CO 0.01 0.12 0.48 0.78 0.02 0.00 0.00 177.57 178.99 3mfw h ASN 294 N 0.49 0.81 -0.54 0.57 2.35 -0.40 -0.04 115.58 118.82 3mfw h ASN 294 Ca 0.13 -0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.84 3mfw h ASN 294 Cb 0.00 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.16 3mfw h ASN 294 CO -0.03 0.57 0.18 0.74 -1.65 0.00 0.00 177.43 177.25 3mfw h THR 295 N 0.96 1.23 -0.96 2.81 2.02 -0.76 -1.55 112.91 116.67 3mfw h THR 295 Ca 0.29 -0.76 0.02 0.00 0.77 0.00 0.00 66.41 66.73 3mfw h THR 295 Cb -0.03 0.71 -0.05 0.00 -1.74 0.00 0.00 68.15 67.04 3mfw h THR 295 CO -0.09 0.28 0.63 0.00 0.37 0.00 0.00 175.52 176.71 3mfw h ALA 296 N 1.04 1.33 -0.40 6.16 0.00 -0.73 0.40 119.26 127.07 3mfw h ALA 296 Ca 0.18 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 3mfw h ALA 296 Cb 0.25 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3mfw h ALA 296 CO -0.01 0.61 -0.01 0.28 0.00 0.00 0.00 179.25 180.12 3mfw h VAL 297 N 1.28 1.26 -0.74 0.00 2.07 -0.76 -0.66 116.25 118.70 3mfw h VAL 297 Ca 0.36 -1.03 -0.02 0.00 0.82 0.00 0.00 66.70 66.83 3mfw h VAL 297 Cb -0.11 1.12 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 3mfw h VAL 297 CO -0.09 0.35 0.40 0.00 0.02 0.00 0.00 177.57 178.25 3mfw h ALA 298 N 0.88 0.94 -0.72 1.67 0.00 -0.66 0.23 119.26 121.62 3mfw h ALA 298 Ca 0.11 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.92 3mfw h ALA 298 Cb 0.49 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 3mfw h ALA 298 CO 0.02 0.46 0.47 0.82 0.00 0.00 0.00 179.25 181.02 3mfw h ILE 299 N 1.02 1.15 -0.36 0.00 1.08 -0.81 -1.24 117.51 118.35 3mfw h ILE 299 Ca 0.26 -0.32 -0.06 0.00 -0.39 0.00 0.00 64.86 64.35 3mfw h ILE 299 Cb 0.05 0.13 -0.01 0.00 -3.07 0.00 0.00 36.82 33.92 3mfw h ILE 299 CO -0.04 0.17 -0.01 0.74 -0.69 0.00 0.00 178.15 178.33 3mfw h THR 300 N 0.94 1.26 -0.60 -0.27 2.02 0.12 -2.62 112.91 113.76 3mfw h THR 300 Ca 0.27 -0.99 -0.03 0.00 0.77 0.00 0.00 66.41 66.43 3mfw h THR 300 Cb -0.06 1.19 -0.03 0.00 -1.74 0.00 0.00 68.15 67.51 3mfw h THR 300 CO -0.08 0.33 0.24 -0.07 0.37 0.00 0.00 175.52 176.31 3mfw h LEU 301 N 0.45 0.80 -1.59 2.58 3.38 -0.38 -1.65 115.31 118.90 3mfw h LEU 301 Ca 0.10 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 3mfw h LEU 301 Cb 0.47 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 3mfw h LEU 301 CO 0.02 0.71 0.22 0.00 0.09 0.00 0.00 178.44 179.48 3mfw h ALA 302 N 1.40 1.70 0.00 1.53 0.00 -0.98 -1.48 119.26 121.44 3mfw h ALA 302 Ca 0.20 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 3mfw h ALA 302 Cb 0.17 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 3mfw h ALA 302 CO -0.02 0.27 -0.02 0.00 0.00 0.00 0.00 179.25 179.48 3mfw n PHE 304 N -3.65 0.52 0.00 0.00 3.72 -0.62 -4.48 117.46 112.95 3mfw n PHE 304 Ca -0.03 -0.96 0.00 0.00 -0.05 0.00 0.00 57.45 56.41 3mfw n PHE 304 Cb 0.11 -0.25 0.00 0.00 -0.94 0.00 0.00 39.48 38.40 3mfw n PHE 304 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3mfw n GLY 305 N -0.94 1.14 3.66 1.37 0.00 -0.89 -4.72 105.19 104.81 3mfw n GLY 305 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 3mfw n GLY 305 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3mfw s LEU 306 N 0.00 4.32 -0.08 0.99 0.20 -0.84 -4.97 118.68 118.30 3mfw s LEU 306 Ca 0.00 2.24 0.02 0.00 0.69 0.00 0.00 54.13 57.08 3mfw s LEU 306 Cb 0.00 -3.53 -0.02 0.00 -0.43 0.00 0.00 46.19 42.21 3mfw s LEU 306 CO 0.00 -0.92 -0.14 0.00 -0.29 0.00 0.00 176.35 174.99 3mfw s ALA 307 N 4.01 2.63 0.46 5.97 0.00 -1.26 -4.30 121.76 129.28 3mfw s ALA 307 Ca 0.74 -0.94 0.14 0.00 0.00 0.00 0.00 51.96 51.89 3mfw s ALA 307 Cb -0.33 -1.06 1.04 0.00 0.00 0.00 0.00 23.12 22.76 3mfw s ALA 307 CO 0.30 0.42 2.02 0.00 0.00 0.00 0.00 175.76 178.51 3mfw h ARG 308 N 5.93 0.04 0.00 0.00 3.08 -1.98 0.12 114.38 121.58 3mfw h ARG 308 Ca -0.37 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.67 3mfw h ARG 308 Cb 1.18 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.22 3mfw h ARG 308 CO 0.52 0.16 0.00 -0.85 -1.07 0.00 0.00 179.97 178.74 3mfw n GLU 309 N -4.38 0.10 0.00 0.04 0.28 -1.26 -4.98 120.64 110.44 3mfw n GLU 309 Ca -0.02 0.35 0.00 0.00 -0.16 0.00 0.00 57.16 57.32 3mfw n GLU 309 Cb 0.20 -1.69 0.00 0.00 1.43 0.00 0.00 31.44 31.39 3mfw n GLU 309 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3mfw n GLY 310 N -0.06 2.07 2.96 -1.84 0.00 0.03 -5.10 105.19 103.25 3mfw n GLY 310 Ca 0.03 -2.05 -0.12 0.00 0.00 0.00 0.00 46.02 43.88 3mfw n GLY 310 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3mfw s ASN 311 N 0.00 -0.02 0.09 1.61 -0.87 -1.26 -4.55 114.94 109.94 3mfw s ASN 311 Ca 0.00 0.01 -0.01 0.00 -1.57 0.00 0.00 52.86 51.29 3mfw s ASN 311 Cb 0.00 0.13 -0.04 0.00 -0.02 0.00 0.00 41.25 41.32 3mfw s ASN 311 CO 0.00 -0.09 0.01 -1.38 -2.57 0.00 0.00 177.10 173.07 3mfw s HIS 312 N -0.31 0.68 0.60 2.20 -3.43 -1.26 -5.12 115.29 108.65 3mfw s HIS 312 Ca -0.04 -1.15 -0.09 0.00 -0.80 0.00 0.00 55.06 52.99 3mfw s HIS 312 Cb -0.02 -0.43 -0.02 0.00 -1.43 0.00 0.00 32.58 30.67 3mfw s HIS 312 CO 0.00 -0.45 0.96 0.15 -2.00 0.00 0.00 174.74 173.41 3mfw s LYS 313 N -3.98 3.33 -1.02 -0.38 1.02 -1.26 -4.92 119.74 112.53 3mfw s LYS 313 Ca 0.15 0.44 -0.08 0.00 0.02 0.00 0.00 55.97 56.50 3mfw s LYS 313 Cb 0.08 -2.17 -0.15 0.00 -0.52 0.00 0.00 37.83 35.06 3mfw s LYS 313 CO -0.04 -0.59 3.15 -0.35 -0.92 0.00 0.00 175.35 176.59 3mfw n PRO 314 N -2.65 3.02 -4.60 -1.68 -0.04 -1.26 -4.80 135.00 122.98 3mfw n PRO 314 Ca 0.05 -1.73 -0.27 0.00 -0.04 0.00 0.00 63.50 61.50 3mfw n PRO 314 Cb 0.55 -2.49 -0.11 0.00 -0.04 0.00 0.00 33.50 31.41 3mfw n PRO 314 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3mfw s ILE 315 N 1.81 2.05 -0.46 0.52 1.09 -1.26 -5.11 121.20 119.84 3mfw s ILE 315 Ca 0.67 -2.05 -0.21 0.00 -1.10 0.00 0.00 60.65 57.96 3mfw s ILE 315 Cb 0.22 -2.91 0.03 0.00 -1.06 0.00 0.00 42.46 38.74 3mfw s ILE 315 CO -0.04 -0.05 0.69 -0.62 -0.10 0.00 0.00 174.94 174.83 3mfw s ASP 316 N -3.68 6.33 0.13 3.58 3.68 -1.26 -4.93 116.67 120.51 3mfw s ASP 316 Ca 0.34 -0.38 0.27 0.00 2.13 0.00 0.00 52.55 54.91 3mfw s ASP 316 Cb 0.08 -2.34 0.98 0.00 -1.45 0.00 0.00 42.92 40.19 3mfw s ASP 316 CO 0.18 -0.86 1.83 -1.22 0.13 0.00 0.00 175.17 175.22 3mfw n TYR 317 N 6.44 0.55 0.79 -5.34 4.01 -1.26 -2.57 117.16 119.78 3mfw n TYR 317 Ca -0.01 0.16 0.02 0.00 -0.16 0.00 0.00 57.90 57.91 3mfw n TYR 317 Cb 0.48 -0.77 0.10 0.00 -0.31 0.00 0.00 39.34 38.84 3mfw n TYR 317 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 3mfw n LEU 318 N -1.95 1.86 0.00 7.72 4.77 -1.26 -5.28 117.00 122.86 3mfw n LEU 318 Ca 0.06 -0.94 0.00 0.00 -0.03 0.00 0.00 56.01 55.10 3mfw n LEU 318 Cb 0.39 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 3mfw n LEU 318 CO 0.29 0.32 0.00 0.59 -1.33 0.00 0.00 177.39 177.26